data_1qxn_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 1qxn _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.559 ' SD ' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.178 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.649 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -58.95 -38.32 92.55 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.961 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -71.42 -38.67 71.39 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.985 0.421 . . . . 0.0 110.488 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.559 ' HG3' ' SD ' ' A' ' 3' ' ' MET . 7.7 mmtt -60.54 -56.37 22.2 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.534 -176.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.649 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 1.1 p90 -76.46 -21.96 55.19 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 119.89 -0.724 . . . . 0.0 111.793 -175.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.603 ' HB2' ' HB3' ' B' ' 75' ' ' ALA . 0.0 OUTLIER -52.45 -46.11 66.34 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 123.447 0.467 . . . . 0.0 111.013 -178.103 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.43 -42.03 81.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.342 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.482 ' HB ' ' CE1' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -67.61 -43.13 81.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.287 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.619 ' HA ' ' HH ' ' B' ' 105' ' ' TYR . 0.6 OUTLIER -57.69 -44.45 85.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.301 179.282 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.648 ' HD2' ' HG3' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -66.46 -26.52 67.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.373 178.117 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.86 -42.37 63.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.078 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.0 -51.03 23.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.173 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.423 ' O ' HG11 ' A' ' 15' ' ' VAL . 2.1 t -64.77 -38.37 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.237 -173.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.648 ' HG3' ' HD2' ' A' ' 12' ' ' LYS . 0.9 OUTLIER -69.55 -32.62 71.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 0.0 111.368 -177.808 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.24 -26.12 66.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.384 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.38 -36.11 80.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.136 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.03 -22.28 49.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.288 0.566 . . . . 0.0 110.962 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.43 -19.13 50.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.544 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.78 -33.81 75.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.12 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.66 ' HB3' ' HD3' ' A' ' 103' ' ' ARG . 8.6 ptm -116.99 -172.61 2.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.211 0.529 . . . . 0.0 112.274 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.6 t -79.84 112.96 18.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.272 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 120.97 29.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.019 0.437 . . . . 0.0 110.491 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.3 mt -118.2 -168.47 1.53 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.902 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -126.61 144.13 48.7 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 173.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.415 ' HB2' ' CD1' ' A' ' 125' ' ' LEU . 1.2 Cg_endo -46.77 -30.37 9.19 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 123.933 3.089 . . . . 0.0 114.209 -174.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm -75.02 -43.8 51.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.943 0.401 . . . . 0.0 110.792 176.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.2 -32.24 73.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.393 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.634 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.01 -47.97 40.42 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.78 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.662 ' HA ' HD11 ' A' ' 34' ' ' LEU . 83.9 t80 -62.97 -33.41 75.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.862 178.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -53.9 -52.57 60.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.187 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.49 ' HB2' HD11 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -74.05 -26.18 60.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.364 179.756 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.662 HD11 ' HA ' ' A' ' 31' ' ' TYR . 99.0 mt -65.64 -48.77 71.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 111.275 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -75.69 -28.55 58.69 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.707 -174.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -86.59 -37.02 18.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.11 0.481 . . . . 0.0 110.511 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -116.48 97.43 50.0 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.77 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.498 ' HA ' ' ND2' ' A' ' 61' ' ' ASN . 35.7 Cg_endo -67.02 3.73 1.45 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 122.912 2.408 . . . . 0.0 112.902 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -91.38 -27.94 18.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.015 0.436 . . . . 0.0 110.24 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.518 HG12 ' HG2' ' A' ' 84' ' ' PRO . 25.0 mt -81.88 109.74 16.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.817 175.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.424 ' CG2' ' HB2' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -99.08 145.65 26.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.697 -175.16 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.604 HD13 ' HB2' ' A' ' 88' ' ' PHE . 2.7 tp -101.44 133.26 46.34 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.46 HD12 HD12 ' A' ' 79' ' ' LEU . 84.6 mt -112.77 117.1 54.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.529 176.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.831 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.1 OUTLIER -99.21 138.38 36.4 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.666 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.17 98.73 5.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.534 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.822 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -156.76 162.89 39.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.445 178.551 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.822 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 3.4 m-20 -80.68 157.97 71.45 Favored Pre-proline 0 C--N 1.318 -0.777 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.162 -174.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.434 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 36.6 Cg_endo -72.1 -23.1 21.83 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.859 2.373 . . . . 0.0 114.758 -170.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.446 ' HB2' ' HG3' ' B' ' 50' ' ' GLU . 3.7 t70 -78.14 -37.86 45.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.704 -0.798 . . . . 0.0 111.763 -177.002 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.4 ' CD ' HH21 ' A' ' 46' ' ' ARG . 1.4 tt0 -70.53 -39.28 74.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.749 175.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.84 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 mp -59.56 -34.8 73.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.293 177.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -78.94 -45.13 21.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.164 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.54 -47.97 13.43 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 6.4 mmm -98.63 -36.25 9.94 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.629 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 173.3 14.15 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.536 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.84 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -143.64 162.28 42.42 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.199 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.462 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.5 Cg_endo -59.53 133.34 51.2 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.391 2.061 . . . . 0.0 113.156 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -95.9 95.36 8.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.063 174.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.666 ' CG2' ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -129.88 145.08 36.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.289 -178.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.84 95.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.308 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.498 ' ND2' ' HA ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -110.89 76.8 1.0 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.255 -178.566 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.831 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 4.9 t80 -120.34 125.92 49.22 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.162 -171.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.42 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 2.6 mtmt -122.88 113.12 18.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 174.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -92.39 113.08 25.25 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.967 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.665 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.744 -174.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.967 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.608 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.2 OUTLIER -45.88 -63.94 1.1 Allowed Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.622 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.608 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 7.7 Cg_exo -74.49 -16.11 21.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.4 2.066 . . . . 0.0 113.159 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.776 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.8 OUTLIER -90.71 -15.66 29.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.33 -175.255 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.692 HD22 ' CD1' ' B' ' 7' ' ' PHE . 42.8 tp -57.13 -53.28 59.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.3 0.571 . . . . 0.0 110.729 -178.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.39 -22.6 63.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.357 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.545 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 4.3 mttm -73.8 -30.12 62.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.765 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.519 ' HB3' ' HE3' ' A' ' 65' ' ' MET . 0.0 OUTLIER -78.18 -37.36 45.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.94 0.4 . . . . 0.0 110.449 -178.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.98 86.8 1.97 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.627 -176.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.46 HD12 HD12 ' A' ' 43' ' ' ILE . 1.0 OUTLIER -129.48 145.12 51.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.872 0.368 . . . . 0.0 111.097 -177.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -129.15 146.58 61.39 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.449 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 40.9 Cg_endo -69.77 9.19 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.987 2.458 . . . . 0.0 113.872 -175.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.49 18.61 15.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.322 0.582 . . . . 0.0 110.004 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -111.63 127.37 26.98 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.442 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.518 ' HG2' HG12 ' A' ' 40' ' ' ILE . 5.9 Cg_exo -75.57 129.35 11.76 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.426 2.084 . . . . 0.0 111.172 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.616 HG22 HD13 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -139.11 151.04 23.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.053 -177.183 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.494 HG21 ' N ' ' A' ' 87' ' ' VAL . 2.8 p -127.32 144.83 36.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.494 ' N ' HG21 ' A' ' 86' ' ' VAL . 8.2 m -112.15 142.24 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.734 0.302 . . . . 0.0 110.725 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.764 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.0 OUTLIER -108.69 158.2 17.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.495 -178.667 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.417 0.627 . . . . 0.0 111.481 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.509 ' HB3' ' O ' ' A' ' 88' ' ' PHE . . . . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 109.908 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -33.49 70.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.712 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -74.23 -30.39 62.15 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.34 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.84 -40.73 54.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.745 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.577 ' HA3' ' HE2' ' A' ' 22' ' ' MET . . . -93.47 -46.12 3.31 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.518 -0.849 . . . . 0.0 113.598 -172.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.481 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.41 -24.24 67.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.705 0.288 . . . . 0.0 111.227 -174.29 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.43 -49.65 66.01 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.442 175.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.57 HD22 HD23 ' A' ' 74' ' ' LEU . 39.4 mt -58.48 -41.95 86.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.446 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.66 ' HD3' ' HB3' ' A' ' 22' ' ' MET . 0.0 OUTLIER -71.53 -27.12 62.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 0.0 110.578 177.356 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.38 -9.35 58.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.705 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.479 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 19.4 m-85 -100.24 -40.86 7.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 144.56 41.13 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.259 175.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -88.05 138.76 31.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.931 0.366 . . . . 0.0 110.367 177.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -61.32 -72.83 0.11 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.874 -174.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.86 107.44 10.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.064 0.459 . . . . 0.0 111.247 -176.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.616 HD13 HG22 ' A' ' 85' ' ' VAL . 1.2 tt -117.61 132.73 66.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.566 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -115.0 146.09 41.59 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.578 -177.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -113.21 141.33 47.09 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 172.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -96.31 111.71 23.69 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.732 0.301 . . . . 0.0 111.806 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 115' ' ' GLY . 1.8 tp10 -62.05 149.7 40.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.099 177.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.586 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 89.86 -108.4 3.51 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.583 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.53 -161.46 32.68 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' MET . . . . . 0.426 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 35.9 tpp -60.5 -32.65 71.65 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.042 0.448 . . . . 0.0 110.725 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -61.79 -33.91 74.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.268 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.586 ' HD3' ' HA3' ' A' ' 115' ' ' GLY . 0.0 OUTLIER -73.85 -33.13 63.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 111.42 0.155 . . . . 0.0 111.42 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.764 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -62.77 -54.04 45.11 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 15.6 mt -62.12 -43.81 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.378 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.419 ' CD ' ' HZ3' ' A' ' 119' ' ' LYS . 1.4 pt-20 -74.79 -33.42 62.25 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -172.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -76.94 3.24 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 122.269 -0.269 . . . . 0.0 111.669 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.11 18.55 74.33 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.359 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.422 HD11 ' CD2' ' A' ' 120' ' ' TRP . 86.8 mt -76.52 154.24 83.75 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-O 120.834 0.349 . . . . 0.0 110.552 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.457 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 26.4 Cg_endo -57.98 111.25 0.79 Allowed 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 123.066 2.511 . . . . 0.0 111.951 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.84 146.97 47.08 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.88 101.55 13.24 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.872 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.915 -175.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' MET . . . . . 0.588 ' SD ' ' HG3' ' B' ' 6' ' ' LYS . 4.8 tpp . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.948 0.404 . . . . 0.0 110.066 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' GLY . . . . . 0.75 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.05 -49.19 81.11 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.599 -0.728 . . . . 0.0 113.276 -177.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -31.91 68.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.064 0.459 . . . . 0.0 111.117 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.588 ' HG3' ' SD ' ' B' ' 3' ' ' MET . 15.0 mmtp -75.57 -57.99 3.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.406 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . 0.75 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -79.23 -23.6 43.63 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.858 -0.737 . . . . 0.0 112.485 -174.489 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -53.82 -42.45 68.44 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.996 0.427 . . . . 0.0 110.536 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.44 -35.34 68.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.307 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.06 -47.53 68.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.458 0.171 . . . . 0.0 111.417 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' PHE . . . . . 0.526 ' CZ ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -57.23 -38.47 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.29 0.567 . . . . 0.0 110.317 179.563 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.1 OUTLIER -68.08 -27.06 66.16 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.371 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.91 -44.29 49.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -69.74 -50.59 41.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.29 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.55 HG13 ' HG2' ' A' ' 71' ' ' GLU . 0.9 OUTLIER -61.57 -33.27 56.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.304 -178.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -71.69 -33.73 69.06 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.423 179.485 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.54 64.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.122 0.486 . . . . 0.0 110.888 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.73 -32.84 70.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.061 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.39 -24.2 42.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.06 0.457 . . . . 0.0 111.024 173.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.38 -26.19 46.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.057 -176.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.557 ' O ' ' HD3' ' B' ' 103' ' ' ARG . 3.8 t0 -85.86 21.03 2.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.659 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' MET . . . . . 0.681 ' HE2' HG12 ' B' ' 110' ' ' ILE . 9.7 mtp -143.38 156.03 44.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.468 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 61.2 t -81.76 100.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' MET . . . . . 0.601 ' HE1' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -74.67 112.85 11.28 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.168 0.509 . . . . 0.0 111.111 -174.75 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . 0.493 HD21 ' HA ' ' B' ' 25' ' ' LEU . 2.5 mt -123.76 144.81 49.46 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.198 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 141.71 49.18 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.203 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -46.77 -24.17 2.86 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.404 3.403 . . . . 0.0 115.083 -174.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -74.43 -43.78 54.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.0 0.428 . . . . 0.0 110.626 177.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -72.65 -32.56 65.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.009 175.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . 0.645 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -66.09 -52.2 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.778 178.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' TYR . . . . . 0.805 ' HA ' HD13 ' B' ' 34' ' ' LEU . 59.8 t80 -63.66 -29.87 71.05 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 122.221 -0.299 . . . . 0.0 111.063 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -52.75 63.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.056 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.517 ' HB2' HD11 ' B' ' 40' ' ' ILE . 0.2 OUTLIER -68.95 -26.51 65.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.259 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.805 HD13 ' HA ' ' B' ' 31' ' ' TYR . 46.8 mt -70.62 -49.69 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.023 0.439 . . . . 0.0 111.261 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -76.28 -24.65 54.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.233 -173.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.65 -34.19 15.53 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.129 -178.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.518 ' HB2' HG13 ' B' ' 40' ' ' ILE . 0.5 OUTLIER -126.64 102.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.563 -177.46 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -70.23 8.29 0.91 Allowed 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 123.327 2.685 . . . . 0.0 113.947 -176.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -92.33 -27.41 17.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.283 0.563 . . . . 0.0 109.588 173.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.926 HG12 ' HG2' ' B' ' 84' ' ' PRO . 2.8 mt -82.53 99.41 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.841 175.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.471 HG21 ' O ' ' B' ' 61' ' ' ASN . 0.2 OUTLIER -90.28 145.17 25.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.362 -176.096 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.552 ' HB2' HD23 ' B' ' 34' ' ' LEU . 2.5 tp -102.89 130.3 49.89 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.669 HG12 ' HE3' ' B' ' 65' ' ' MET . 94.4 mt -109.01 118.7 57.12 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.807 178.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.805 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -97.13 122.48 40.18 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.633 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.56 98.41 6.43 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 115.045 -0.98 . . . . 0.0 108.632 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . 0.631 ' HG3' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -161.41 169.89 21.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.993 -174.123 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.96 142.44 76.31 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 177.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -78.81 -19.23 11.22 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.683 2.255 . . . . 0.0 114.028 -174.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.41 -48.88 25.04 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 122.097 -0.377 . . . . 0.0 111.391 -176.002 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' GLU . . . . . 0.446 ' HG3' ' HB2' ' A' ' 49' ' ' ASP . 0.9 OUTLIER -67.74 -29.33 68.53 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 174.561 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -44.5 97.11 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.051 174.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -59.39 -38.68 81.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.98 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.61 -47.98 10.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.823 -171.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.71 -34.68 11.85 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -170.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.87 163.64 11.31 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.655 178.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.04 152.58 70.32 Favored Pre-proline 0 C--N 1.327 -0.4 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -58.39 122.79 12.27 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.521 2.147 . . . . 0.0 112.893 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -98.61 79.72 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.339 0.59 . . . . 0.0 110.272 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.599 HG23 ' HB2' ' B' ' 62' ' ' TYR . 1.2 m -113.43 162.78 11.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 178.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -41.33 88.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.315 -174.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.471 ' O ' HG21 ' B' ' 41' ' ' THR . 19.9 p30 -121.26 67.84 0.88 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.522 0.677 . . . . 0.0 111.208 -177.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' TYR . . . . . 0.805 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -105.52 125.32 50.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.808 176.736 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -123.01 120.88 34.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.004 0.431 . . . . 0.0 110.617 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' HIS . . . . . 0.464 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 12.9 t-160 -87.22 113.69 23.18 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' MET . . . . . 0.905 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.636 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.775 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.634 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -44.79 -59.49 4.05 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -174.836 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . 0.634 ' HD3' ' CD ' ' B' ' 71' ' ' GLU . 11.9 Cg_exo -73.93 -17.38 22.52 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.453 2.102 . . . . 0.0 113.392 -176.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.905 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -91.11 -21.88 20.98 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.73 0.3 . . . . 0.0 110.636 -177.502 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.54 ' HB2' HD13 ' B' ' 70' ' ' LEU . 10.6 tp -62.34 -29.02 70.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.452 0.644 . . . . 0.0 110.885 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.603 ' HB3' ' HB2' ' A' ' 8' ' ' ASP . . . -77.22 -30.24 54.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.782 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.45 -7.18 32.19 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -171.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -27.02 57.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.807 0.337 . . . . 0.0 111.483 -176.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.15 51.23 2.45 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.306 -174.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 49.7 mt -109.46 142.79 39.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.914 0.387 . . . . 0.0 110.201 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.486 ' C ' ' H ' ' B' ' 82' ' ' GLU . 16.9 t70 -136.1 138.93 28.7 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.377 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 48.7 Cg_exo -60.95 16.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.631 2.887 . . . . 0.0 114.549 -175.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . 0.486 ' H ' ' C ' ' B' ' 80' ' ' ASP . 0.2 OUTLIER -107.68 -6.38 16.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 174.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -103.86 143.85 27.49 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.986 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.926 ' HG2' HG12 ' B' ' 40' ' ' ILE . 8.4 Cg_endo -83.12 141.01 10.19 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 C-N-CA 122.98 2.453 . . . . 0.0 111.108 174.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.534 HG22 HD13 ' B' ' 110' ' ' ILE . 0.0 OUTLIER -140.45 146.79 23.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.43 -178.324 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.405 ' HA ' ' O ' ' B' ' 111' ' ' TYR . 2.2 p -124.79 140.3 48.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . 0.669 ' HB ' ' HB3' ' B' ' 95' ' ' ALA . 4.2 m -107.23 125.51 63.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.656 -177.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' PHE . . . . . 0.752 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 3.7 t80 -99.85 150.24 22.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.354 -178.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . 0.631 ' SG ' ' HG3' ' B' ' 46' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.392 0 CA-C-O 121.459 0.647 . . . . 0.0 111.701 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . 0.669 ' HB3' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.527 0.081 0 CA-C-O 120.819 0.343 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.34 -32.69 66.98 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.145 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -71.35 -27.9 63.69 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.079 0.466 . . . . 0.0 110.81 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.47 -44.58 57.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.931 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 99' ' ' GLY . . . . . 0.61 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -87.05 -40.93 6.84 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.782 -174.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 100' ' ' LYS . . . . . 0.498 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -66.6 -29.54 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.004 0.402 . . . . 0.0 111.295 -174.883 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 101' ' ' THR . . . . . 0.455 ' HA ' ' HG3' ' B' ' 104' ' ' GLU . 8.0 m -72.74 -35.66 67.57 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.939 0.4 . . . . 0.0 111.127 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 102' ' ' LEU . . . . . 0.48 HD21 ' HA ' ' B' ' 102' ' ' LEU . 11.2 mt -66.61 -37.01 83.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 103' ' ' ARG . . . . . 0.557 ' HD3' ' O ' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -67.03 -25.07 66.09 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 179.194 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.455 ' HG3' ' HA ' ' B' ' 101' ' ' THR . 2.5 mt-10 -68.73 -6.6 27.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.23 174.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . 0.619 ' HH ' ' HA ' ' A' ' 11' ' ' PHE . 17.2 m-85 -110.18 -11.2 14.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.68 0.276 . . . . 0.0 110.744 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 97.75 60.47 0.93 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.349 -0.929 . . . . 0.0 113.2 174.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 107' ' ' PHE . . . . . 0.427 ' CE1' HD23 ' B' ' 102' ' ' LEU . 2.1 m-85 -92.46 158.16 16.18 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.745 -0.268 . . . . 0.0 110.291 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -61.26 -70.27 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.535 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.6 113.97 9.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 178.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 110' ' ' ILE . . . . . 0.681 HG12 ' HE2' ' B' ' 22' ' ' MET . 1.3 tt -113.06 123.5 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.625 0.726 . . . . 0.0 110.936 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 111' ' ' TYR . . . . . 0.405 ' O ' ' HA ' ' B' ' 86' ' ' VAL . 1.3 m-85 -113.99 146.81 39.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.271 -176.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.601 ' HB3' ' HE1' ' B' ' 24' ' ' MET . 24.3 t-20 -111.33 138.67 47.52 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.493 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 8.4 m -87.57 111.84 21.64 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.982 0.42 . . . . 0.0 112.038 -174.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . 0.407 ' HG2' ' SD ' ' B' ' 24' ' ' MET . 0.8 OUTLIER -63.21 148.28 48.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.253 177.081 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 85.38 -109.23 3.29 Favored Glycine 0 N--CA 1.442 -0.95 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.175 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 162.57 -157.77 29.79 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -60.6 -33.89 73.41 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.122 0.486 . . . . 0.0 110.144 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.52 -34.5 74.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.854 179.294 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 119' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -72.74 -32.38 65.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.535 0.207 . . . . 0.0 111.384 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 120' ' ' TRP . . . . . 0.752 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 20.2 t-105 -64.39 -54.63 29.78 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.84 -43.41 98.86 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.499 0.19 . . . . 0.0 111.163 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.579 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.6 OUTLIER -63.09 -33.08 74.69 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.898 -176.252 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . 0.582 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -82.96 -3.91 57.67 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.992 -177.28 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.18 27.75 73.6 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.672 -178.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.582 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 70.1 mt -72.47 161.97 76.36 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.273 . . . . 0.0 110.283 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . 0.575 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 21.8 Cg_endo -57.21 108.68 0.38 Allowed 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.851 2.367 . . . . 0.0 111.642 178.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.63 149.99 51.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 2.7 mt . . . . . 0 C--N 1.318 -0.767 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.694 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.1 mmt . . . . . 0 C--O 1.232 0.183 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.655 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -52.16 -26.57 20.92 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 114.39 -1.277 . . . . 0.0 113.214 -179.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -33.27 57.62 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.541 ' HG3' ' N ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -61.29 -46.57 89.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.395 . . . . 0.0 112.001 -174.845 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.655 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 1.8 p90 -91.52 -20.51 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.821 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.51 -50.57 65.13 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 110.911 -177.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.71 -32.11 73.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.513 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -42.68 72.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.495 178.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.601 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.1 OUTLIER -56.82 -38.27 72.36 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.144 0.497 . . . . 0.0 110.152 176.435 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -32.17 73.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.652 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.32 -45.33 32.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.763 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -68.86 -51.45 40.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.657 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.434 ' O ' HG11 ' A' ' 15' ' ' VAL . 22.3 t -61.97 -34.13 61.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.945 -176.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -58.7 -35.24 72.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.552 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -28.99 69.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 111.217 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.7 -31.75 61.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.622 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.532 ' HG3' ' SD ' ' A' ' 24' ' ' MET . 0.6 OUTLIER -76.9 -24.02 52.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.664 0.745 . . . . 0.0 110.119 173.74 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.9 -17.4 53.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.676 -178.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' A' ' 100' ' ' LYS . 0.4 OUTLIER -86.58 19.04 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -175.634 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.454 ' HB3' ' HE1' ' A' ' 22' ' ' MET . 0.1 OUTLIER -149.35 157.68 43.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.537 178.197 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -75.7 103.05 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.179 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.558 ' SD ' ' HG2' ' A' ' 114' ' ' GLU . 1.4 mmt -72.07 125.9 28.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.693 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -141.65 152.58 44.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.322 -178.033 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 139.8 37.13 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.774 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -50.46 -19.38 4.72 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.578 2.852 . . . . 0.0 113.982 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -46.01 51.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.848 0.356 . . . . 0.0 111.066 176.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.492 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 1.2 t70 -77.39 -29.32 53.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.971 0.415 . . . . 0.0 110.458 178.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.94 -36.25 77.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.43 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.483 ' HA ' HD11 ' A' ' 34' ' ' LEU . 60.6 t80 -74.38 -39.76 62.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.777 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.492 ' HG2' ' HA ' ' A' ' 29' ' ' ASP . 2.4 pttt -63.08 -41.08 99.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.98 -0.288 . . . . 0.0 111.592 -174.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 HG23 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -74.19 -26.19 60.13 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.764 0.316 . . . . 0.0 110.612 176.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.551 HD13 ' HB2' ' A' ' 42' ' ' LEU . 4.6 mt -61.16 -54.43 44.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.408 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -75.8 -28.32 58.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.547 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -84.6 -22.65 29.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.825 0.345 . . . . 0.0 111.158 -176.166 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -121.05 106.83 38.37 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.209 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.468 ' HA ' HD22 ' A' ' 61' ' ' ASN . 14.0 Cg_exo -67.69 -0.94 5.89 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.817 2.345 . . . . 0.0 112.288 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.49 -25.33 15.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.066 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.62 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 53.6 mt -84.84 111.5 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.067 176.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.48 ' HA ' ' HB2' ' A' ' 61' ' ' ASN . 0.2 OUTLIER -106.71 144.91 32.68 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.967 -176.647 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.624 HD11 HG11 ' A' ' 86' ' ' VAL . 25.8 tp -101.94 125.97 48.74 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.46 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 4.1 mt -108.96 106.24 20.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.176 174.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.76 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 3.6 t0 -83.2 125.18 31.28 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . 0.473 ' CG2' ' HA ' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -110.31 97.19 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.603 0.716 . . . . 0.0 109.122 -178.731 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.557 HH11 ' HG2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -162.51 -164.27 1.0 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.405 -176.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.47 ' CG ' HH12 ' B' ' 46' ' ' ARG . 11.7 m-20 -119.92 143.87 36.18 Favored Pre-proline 0 C--N 1.325 -0.472 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -177.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -65.68 -24.34 55.3 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 123.064 2.509 . . . . 0.0 114.194 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.82 -48.06 34.09 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.359 -176.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -27.35 64.56 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.137 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.516 HD22 ' HB3' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -61.28 -43.3 99.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.943 173.253 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -59.97 -35.95 76.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.578 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.15 -37.31 23.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.336 -175.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.3 mmm -100.47 -34.4 9.95 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -173.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 119.19 169.01 14.2 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 121.138 -0.553 . . . . 0.0 112.059 -178.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HB3' HD22 ' A' ' 51' ' ' LEU . 6.2 pttt -138.3 158.07 71.44 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.434 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 19.8 Cg_exo -68.2 133.87 29.86 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.315 2.01 . . . . 0.0 113.137 -176.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 21.3 t0 -97.13 86.42 3.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 176.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.579 HG21 ' HB2' ' A' ' 62' ' ' TYR . 6.5 m -133.28 159.66 42.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.307 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.928 -175.199 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.48 ' HB2' ' HA ' ' A' ' 41' ' ' THR . 0.4 OUTLIER -116.99 84.34 2.13 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.902 0.382 . . . . 0.0 110.737 -177.302 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.76 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 5.8 t80 -125.51 126.94 45.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.401 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.468 ' HD2' ' HB3' ' A' ' 77' ' ' SER . 8.5 mttm -127.34 126.88 43.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.231 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -96.59 120.96 37.86 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.503 0.192 . . . . 0.0 110.668 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.728 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.365 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 177.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.728 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.702 ' HG3' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -53.51 -42.76 93.58 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.455 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.702 ' HD3' ' HG3' ' A' ' 71' ' ' GLU . 9.7 Cg_exo -71.95 -18.06 28.13 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.573 1.516 . . . . 0.0 111.856 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.436 HD21 ' HA ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -97.6 -21.81 16.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.81 -176.746 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.579 HD23 HD22 ' A' ' 102' ' ' LEU . 15.3 tp -55.14 -56.63 17.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.971 -177.01 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.33 -19.91 64.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.039 -175.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -85.2 -12.26 53.07 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.468 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 20.3 m -105.42 35.9 2.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -173.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.04 56.98 5.0 Favored Glycine 0 C--N 1.335 0.474 0 O-C-N 123.365 0.415 . . . . 0.0 113.526 174.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.445 HD11 HD13 ' A' ' 74' ' ' LEU . 4.6 mt -109.19 140.98 42.09 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.769 0.319 . . . . 0.0 110.79 -178.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.55 154.64 76.89 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -68.74 2.67 2.79 Favored 'Trans proline' 0 CA--C 1.529 0.231 0 C-N-CA 122.802 2.335 . . . . 0.0 113.752 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.9 26.09 10.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.368 0.604 . . . . 0.0 110.176 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.8 mmtm -107.26 115.94 58.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -178.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.62 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 5.8 Cg_exo -74.06 103.75 1.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.574 2.182 . . . . 0.0 109.951 173.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.536 HG21 HG13 ' A' ' 110' ' ' ILE . 15.6 m -123.16 154.91 28.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.468 0.652 . . . . 0.0 111.79 -171.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.624 HG11 HD11 ' A' ' 42' ' ' LEU . 1.4 p -122.68 145.48 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.766 174.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 43' ' ' ILE . 5.2 m -110.1 129.78 64.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.67 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 5.2 t80 -104.87 133.66 49.3 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.176 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' CYS . . . . . 0.891 ' HB3' ' HB1' ' A' ' 95' ' ' ALA . 35.5 t . . . . . 0 C--O 1.234 0.283 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.891 ' HB1' ' HB3' ' A' ' 89' ' ' CYS . . . . . . . . 0 N--CA 1.468 0.473 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.447 ' HA ' ' SD ' ' A' ' 22' ' ' MET . . . -57.1 -36.94 71.23 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.73 -35.33 77.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.525 0.202 . . . . 0.0 111.175 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.516 ' HB3' HD23 ' A' ' 70' ' ' LEU . . . -75.01 -53.44 8.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.124 0.488 . . . . 0.0 110.926 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.44 -53.97 25.77 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.719 -175.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.571 ' HB2' ' HB3' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -62.88 -37.33 86.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.682 0.277 . . . . 0.0 111.176 -173.192 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.515 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 11.0 m -72.43 -39.52 67.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.579 HD22 HD23 ' A' ' 74' ' ' LEU . 11.7 mt -64.83 -47.7 77.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.689 0.28 . . . . 0.0 111.422 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.789 ' HA ' ' HB2' ' A' ' 107' ' ' PHE . 1.7 ptm180 -63.6 -27.08 68.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.102 0.477 . . . . 0.0 110.734 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.73 -5.42 25.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.232 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -110.68 -6.64 14.78 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.197 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.56 31.62 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.919 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . 0.789 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 2.3 m-85 -81.56 142.5 32.77 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.418 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.1 tttt -62.88 -87.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.445 -176.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.418 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -116.45 120.88 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.371 -177.2 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.536 HG13 HG21 ' A' ' 85' ' ' VAL . 0.5 OUTLIER -125.52 129.42 72.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -178.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -118.6 154.55 32.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.327 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.503 ' HB3' ' HE1' ' A' ' 24' ' ' MET . 39.5 t-20 -131.27 158.49 40.47 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -82.09 139.14 34.59 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.113 0.482 . . . . 0.0 111.478 -176.31 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.558 ' HG2' ' SD ' ' A' ' 24' ' ' MET . 0.0 OUTLIER -99.68 18.81 17.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 176.595 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.76 -75.73 0.16 Allowed Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.928 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 150.34 174.86 21.88 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.014 -0.613 . . . . 0.0 111.96 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' MET . . . . . 0.535 ' SD ' ' HD2' ' A' ' 46' ' ' ARG . 19.7 ttm -64.9 -36.37 84.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.419 0.628 . . . . 0.0 109.753 176.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -64.38 -27.78 69.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.044 177.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.407 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -69.37 -32.44 71.48 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 116.791 -0.186 . . . . 0.0 111.107 -179.165 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.67 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 27.8 t-105 -56.2 -52.29 64.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.3 mt -66.03 -40.86 91.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.444 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -68.13 -43.07 79.17 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.725 -175.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 119' ' ' LYS . 65.1 mt-10 -69.69 -18.12 63.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.763 0.316 . . . . 0.0 110.816 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 93.65 25.04 19.21 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.488 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.2 mt -80.45 152.46 73.05 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.624 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 13.8 Cg_endo -56.32 120.89 9.06 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 123.154 2.569 . . . . 0.0 112.286 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.63 157.29 45.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.469 -177.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.447 ' HB2' ' HG3' ' A' ' 56' ' ' LYS . 2.9 mt -110.62 101.66 10.3 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.09 178.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.322 -0.626 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 120.758 0.313 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' GLY . . . . . 0.659 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -56.46 -27.07 53.25 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.469 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -74.61 -33.92 62.72 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.892 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.501 ' HG3' ' N ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -64.59 -47.05 80.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.872 -174.793 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . 0.659 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 11.8 p90 -84.44 -24.26 29.6 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.38 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.85 -48.37 70.04 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.788 -178.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.23 -43.61 98.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.407 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -43.09 99.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.736 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' PHE . . . . . 0.673 ' CZ ' HD22 ' A' ' 70' ' ' LEU . 2.1 t80 -56.48 -41.24 76.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.292 0.568 . . . . 0.0 110.339 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' LYS . . . . . 0.63 ' HD2' ' HB2' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.87 -26.97 67.88 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.756 179.361 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.81 -40.57 61.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.075 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -71.28 -50.43 32.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.317 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -33.45 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.146 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -66.79 -40.19 88.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.794 0.33 . . . . 0.0 111.268 178.026 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.54 -26.32 68.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.447 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.8 71.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.6 -178.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -21.35 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.03 0.443 . . . . 0.0 111.092 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.0 -19.65 62.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.33 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -78.42 -9.26 59.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.953 0.406 . . . . 0.0 111.345 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' MET . . . . . 0.529 ' HE3' HG23 ' B' ' 87' ' ' VAL . 11.8 mtp -116.93 165.7 13.03 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 122.212 -0.305 . . . . 0.0 110.998 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.53 111.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 174.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' MET . . . . . 0.645 ' HB3' ' HG3' ' B' ' 114' ' ' GLU . 0.7 OUTLIER -78.67 105.43 9.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.869 -175.109 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . 0.421 HD21 ' HA ' ' B' ' 25' ' ' LEU . 0.5 OUTLIER -121.78 148.26 44.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.505 0.669 . . . . 0.0 111.333 -177.039 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.99 137.05 33.37 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.207 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.467 ' HB2' HD13 ' B' ' 125' ' ' LEU . 4.4 Cg_exo -41.09 -31.65 0.86 Allowed 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 124.632 3.555 . . . . 0.0 115.388 -175.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.64 ' HG3' ' OE1' ' B' ' 123' ' ' GLU . 13.5 mtmm -73.43 -40.86 63.9 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.41 0.55 . . . . 0.0 110.738 178.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -69.66 -34.91 74.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.151 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.1 -43.27 78.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.362 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' TYR . . . . . 0.438 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 73.2 t80 -67.07 -31.09 71.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.327 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 tptt -61.58 -52.73 63.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.825 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.71 ' HB2' HD11 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -72.26 -26.62 62.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 179.755 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.584 HD13 ' HB2' ' B' ' 42' ' ' LEU . 5.1 mt -59.55 -55.39 35.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.0 mm100 -74.1 -32.88 63.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.174 -175.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.98 -40.67 68.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.259 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -108.5 113.61 59.93 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.371 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.45 -3.61 12.16 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 0.0 112.913 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -103.89 -16.64 15.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.538 -178.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.71 HD11 ' HB2' ' B' ' 33' ' ' LEU . 16.3 mt -81.12 109.02 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-O 121.25 0.548 . . . . 0.0 109.927 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.585 HG22 ' HG3' ' B' ' 63' ' ' LYS . 97.0 m -97.68 142.59 29.29 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.262 -176.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.584 ' HB2' HD13 ' B' ' 34' ' ' LEU . 11.3 tp -103.8 126.45 50.94 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 169.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.85 118.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.794 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -95.16 126.45 40.5 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.619 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -115.63 97.77 6.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.677 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . 0.47 HH12 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -168.48 179.92 4.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.558 -177.738 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -98.68 154.79 37.3 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.237 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.28 -19.19 38.74 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.736 2.291 . . . . 0.0 113.452 -176.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -45.43 23.77 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.484 -178.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -30.63 63.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.67 -46.53 88.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.751 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.57 -31.83 71.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -85.06 -37.24 20.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' MET . . . . . 0.426 ' HE2' ' HB3' ' B' ' 117' ' ' MET . 5.5 mtm -98.93 -19.51 17.29 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -172.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 98.77 165.62 30.47 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.729 -175.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -143.58 145.01 29.71 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . 0.452 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 13.8 Cg_endo -61.57 135.55 57.6 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.846 2.364 . . . . 0.0 112.724 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -112.32 84.24 1.94 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.378 178.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.425 HG22 HD23 ' B' ' 34' ' ' LEU . 3.5 m -121.69 167.22 15.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.381 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 mttm -60.43 -47.9 84.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -174.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.72 71.06 0.76 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.143 0.496 . . . . 0.0 110.906 -177.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' TYR . . . . . 0.794 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -114.92 131.59 56.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 177.239 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.588 ' HD2' ' HB3' ' B' ' 77' ' ' SER . 1.0 OUTLIER -133.8 126.84 31.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.261 0.553 . . . . 0.0 110.313 179.018 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -82.16 122.16 27.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.79 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' MET . . . . . 0.797 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.223 -177.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.591 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.423 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.474 ' H ' ' HG3' ' B' ' 71' ' ' GLU . 0.0 OUTLIER -50.2 -46.55 83.03 Favored Pre-proline 0 N--CA 1.474 0.755 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.483 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . 0.45 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 34.1 Cg_exo -61.24 -18.55 59.29 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.969 1.779 . . . . 0.0 112.454 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.797 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -105.68 -21.14 13.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 0.0 110.52 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.649 HD22 ' CD1' ' A' ' 7' ' ' PHE . 9.7 tp -64.36 -33.32 75.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.536 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.65 -24.29 45.27 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.81 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 35.1 mtpt -86.69 -2.53 58.6 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -175.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' SER . . . . . 0.588 ' HB3' ' HD2' ' B' ' 63' ' ' LYS . 20.1 m -116.55 35.59 4.5 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 38.44 56.25 1.97 Allowed Glycine 0 C--N 1.338 0.661 0 O-C-N 123.626 0.579 . . . . 0.0 114.151 173.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.419 HD11 HD13 ' B' ' 74' ' ' LEU . 73.6 mt -103.25 140.04 37.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 0.0 110.542 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.624 ' HB2' ' HG3' ' B' ' 83' ' ' LYS . 11.0 m-20 -126.06 140.71 37.59 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' PRO . . . . . 0.531 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 38.6 Cg_endo -66.16 6.34 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.812 2.342 . . . . 0.0 113.162 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . 0.404 ' H ' ' HG3' ' B' ' 82' ' ' GLU . 0.9 OUTLIER -105.87 -7.02 18.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.942 0.401 . . . . 0.0 110.727 176.55 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' LYS . . . . . 0.624 ' HG3' ' HB2' ' B' ' 80' ' ' ASP . 3.0 mttp -96.13 133.22 25.42 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.837 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.477 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.9 Cg_exo -72.56 123.04 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.645 2.23 . . . . 0.0 111.382 176.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 25.6 m -128.5 155.53 40.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.85 0.357 . . . . 0.0 110.717 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.523 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 1.4 p -129.99 144.04 39.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . 0.529 HG23 ' HE3' ' B' ' 22' ' ' MET . 12.0 m -105.83 129.31 59.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.895 0.378 . . . . 0.0 110.433 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' PHE . . . . . 0.771 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 3.3 t80 -105.84 130.04 53.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.666 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.393 0 O-C-N 125.194 1.559 . . . . 0.0 107.087 -177.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.203 0 CA-C-O 120.762 0.315 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.59 75.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.255 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -68.22 -30.79 69.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.028 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 98' ' ' ALA . . . . . 0.495 ' HB3' HD23 ' B' ' 70' ' ' LEU . . . -76.68 -38.39 54.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.707 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 99' ' ' GLY . . . . . 0.445 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -96.61 -41.85 3.52 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.939 -171.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -24.6 67.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.011 0.434 . . . . 0.0 110.867 -176.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.86 -53.94 11.66 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.574 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 32.2 mt -55.28 -44.6 75.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.797 -175.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 103' ' ' ARG . . . . . 0.609 ' HB3' HG23 ' B' ' 110' ' ' ILE . 0.0 OUTLIER -64.96 -31.17 72.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 110.811 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -75.52 -6.71 51.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.222 176.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . 0.601 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 16.5 m-30 -99.91 -11.36 20.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.953 0.406 . . . . 0.0 110.132 177.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.09 25.75 2.2 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.096 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 107' ' ' PHE . . . . . 0.576 ' HB2' ' HA ' ' B' ' 103' ' ' ARG . 2.3 m-85 -76.09 152.0 36.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 0.0 110.661 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -75.55 -77.7 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.335 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.39 109.31 13.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.005 0.431 . . . . 0.0 110.931 -178.199 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 110' ' ' ILE . . . . . 0.609 HG23 ' HB3' ' B' ' 103' ' ' ARG . 1.8 tt -114.57 129.68 70.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.587 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 111' ' ' TYR . . . . . 0.523 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 4.1 m-85 -113.37 143.72 44.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.056 -174.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.584 ' HB3' ' HE1' ' B' ' 24' ' ' MET . 19.5 t-20 -113.68 140.3 48.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 173.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.462 ' C ' ' H ' ' B' ' 115' ' ' GLY . 15.7 m -83.01 108.32 16.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.816 0.341 . . . . 0.0 111.634 -176.17 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . 0.645 ' HG3' ' HB3' ' B' ' 24' ' ' MET . 0.5 OUTLIER -71.99 30.16 0.05 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.645 -176.012 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . 0.538 ' HA3' ' HG2' ' B' ' 119' ' ' LYS . . . -145.1 -73.83 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.28 178.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 135.01 -177.63 19.17 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.675 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 117' ' ' MET . . . . . 0.426 ' HB3' ' HE2' ' B' ' 54' ' ' MET . 0.0 OUTLIER -60.89 -32.57 72.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.207 0.527 . . . . 0.0 110.812 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.458 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 30.0 p-10 -66.24 -28.85 69.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.936 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 119' ' ' LYS . . . . . 0.538 ' HG2' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -74.11 -33.21 63.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.301 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 120' ' ' TRP . . . . . 0.771 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 19.3 t-105 -58.93 -49.91 76.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.913 0.387 . . . . 0.0 110.314 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.1 mt -68.67 -36.86 79.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.972 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.458 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.7 OUTLIER -68.32 -44.53 75.19 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . 0.64 ' OE1' ' HG3' ' B' ' 28' ' ' LYS . 68.1 mt-10 -80.1 8.61 6.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -176.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.58 21.36 77.28 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.245 172.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.467 HD13 ' HB2' ' B' ' 27' ' ' PRO . 96.0 mt -79.75 158.92 72.52 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-O 120.708 0.289 . . . . 0.0 111.001 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 41.5 Cg_endo -65.51 107.8 1.09 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.878 2.385 . . . . 0.0 112.326 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.84 150.39 46.46 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.321 -0.634 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.407 ' HB2' ' HD2' ' B' ' 81' ' ' PRO . 1.4 mpp? . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 120.823 0.345 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.763 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -59.65 -39.41 95.13 Favored Glycine 0 C--O 1.226 -0.395 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.748 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -39.47 91.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.045 0.45 . . . . 0.0 110.532 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.4 -55.78 29.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.106 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.921 ' HE2' ' HD3' ' B' ' 81' ' ' PRO . 3.0 p90 -78.97 -22.84 45.04 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.71 -176.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -54.31 -45.54 72.62 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.476 0.485 . . . . 0.0 110.613 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.05 91.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.945 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.413 ' HG1' ' HA ' ' A' ' 7' ' ' PHE . 0.3 OUTLIER -60.94 -41.72 96.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.069 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -58.76 -45.73 89.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.072 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -66.04 -27.85 68.41 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.694 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.46 -39.78 62.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -72.66 -49.06 34.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.693 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.48 ' CG1' ' HG2' ' B' ' 71' ' ' GLU . 1.4 t -64.14 -34.08 66.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.605 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -67.3 -30.85 70.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.588 0.232 . . . . 0.0 111.085 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.84 -25.56 67.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.006 0.432 . . . . 0.0 110.904 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.6 -29.89 63.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.103 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.35 -23.35 50.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.196 0.522 . . . . 0.0 110.836 174.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.82 -19.9 36.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.976 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.19 -21.9 66.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.155 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.579 ' HG3' ' HB2' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -138.24 -174.88 3.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.996 0.427 . . . . 0.0 111.621 -177.527 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.7 t -87.22 112.95 23.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.08 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.48 114.1 19.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.44 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.429 HD21 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -121.61 143.08 49.52 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 -177.25 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -73.97 140.14 77.07 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.893 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -43.28 -36.27 6.11 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 124.232 3.288 . . . . 0.0 114.773 -175.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -41.26 61.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.927 0.394 . . . . 0.0 111.216 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -30.1 70.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.253 177.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.438 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.47 -45.69 52.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.604 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.68 ' HA ' HD13 ' A' ' 34' ' ' LEU . 60.4 t80 -63.38 -31.87 73.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.822 0.344 . . . . 0.0 111.097 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -56.87 -52.97 63.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.306 -178.649 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.441 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -70.4 -26.51 63.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.029 178.56 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.712 HD22 HG23 ' A' ' 40' ' ' ILE . 75.1 mt -64.34 -46.64 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.029 0.442 . . . . 0.0 111.008 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.705 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 1.2 pp0? -75.98 -29.51 58.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.572 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.63 -25.38 23.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -177.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -122.53 97.42 44.7 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.74 0.48 4.2 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.021 2.481 . . . . 0.0 112.818 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -95.43 -23.59 17.07 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.712 HG23 HD22 ' A' ' 34' ' ' LEU . 51.1 mt -80.07 112.38 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.172 173.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.476 HG21 ' HB2' ' A' ' 61' ' ' ASN . 0.2 OUTLIER -105.56 145.71 30.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.356 -174.192 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.575 HD11 HG12 ' A' ' 86' ' ' VAL . 4.3 tp -102.3 128.24 48.94 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.53 HD12 HD13 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -108.55 117.09 53.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 175.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.821 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.9 OUTLIER -105.4 138.13 42.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.224 -175.226 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.67 98.59 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.074 175.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.656 ' HD3' ' HG3' ' A' ' 117' ' ' MET . 0.2 OUTLIER -144.62 147.63 33.34 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.331 -176.881 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 1.556 ' HB3' ' CG ' ' B' ' 47' ' ' ASP . 70.5 m-20 -62.21 136.11 95.34 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 123.392 0.432 . . . . 0.0 111.086 -177.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -61.6 -31.38 86.94 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.07 2.514 . . . . 0.0 113.1 -177.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -78.37 -36.6 45.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.815 ' HB2' ' HB2' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -67.94 -34.53 76.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.36 175.355 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.636 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 tp -57.9 -34.59 69.98 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.418 0.628 . . . . 0.0 110.315 176.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -75.74 -39.1 57.77 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.763 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.88 -48.25 11.77 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.454 ' O ' HD12 ' A' ' 121' ' ' LEU . 2.2 mtm -97.54 -36.61 10.25 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.595 -174.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.28 172.79 13.53 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.248 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.636 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -136.11 152.06 74.73 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.425 ' HD3' ' HE3' ' A' ' 117' ' ' MET . 11.8 Cg_endo -61.42 126.04 18.28 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.088 1.859 . . . . 0.0 112.769 -177.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.634 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 63.5 t0 -87.71 87.93 7.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.283 175.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.556 ' CG2' ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -123.27 144.91 31.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.79 179.354 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.705 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.69 -42.14 71.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.036 -176.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.476 ' HB2' HG21 ' A' ' 41' ' ' THR . 7.3 p30 -114.47 72.97 0.8 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.25 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.821 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 7.5 t80 -97.47 117.91 32.78 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.474 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.427 ' HB3' ' HE2' ' A' ' 65' ' ' MET . 6.4 mtmm -117.97 110.83 18.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.962 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -83.5 116.3 22.48 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.917 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.54 0 CA-C-O 120.997 0.427 . . . . 0.0 110.989 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.917 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.574 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -45.38 -56.52 9.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.617 ' O ' ' HG3' ' A' ' 76' ' ' LYS . 11.5 Cg_exo -72.92 -18.32 24.53 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.898 1.732 . . . . 0.0 113.026 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.697 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 1.0 OUTLIER -90.44 -16.42 29.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.042 0.449 . . . . 0.0 110.384 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.683 HD13 HD11 ' A' ' 79' ' ' LEU . 42.1 tp -68.11 -35.87 78.84 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.134 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.42 -31.21 53.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.329 175.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 3.0 mttm -70.08 -25.09 63.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.912 -176.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.92 -44.74 13.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.946 0.403 . . . . 0.0 110.634 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.52 58.0 0.97 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.776 -0.726 . . . . 0.0 111.598 -176.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.683 HD11 HD13 ' A' ' 74' ' ' LEU . 7.4 mt -91.6 145.02 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.604 0.24 . . . . 0.0 110.467 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -122.15 140.15 31.85 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -67.37 5.56 0.89 Allowed 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.881 2.388 . . . . 0.0 114.371 -173.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -101.85 -11.41 19.06 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.779 -0.575 . . . . 0.0 110.437 175.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.8 mptp? -87.9 119.96 70.66 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.257 -179.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.671 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 12.5 Cg_exo -67.68 133.46 29.74 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.683 2.255 . . . . 0.0 111.086 176.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 3.8 m -136.19 155.57 35.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.047 0.451 . . . . 0.0 111.213 -177.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.575 HG12 HD11 ' A' ' 42' ' ' LEU . 2.2 p -124.68 141.86 43.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.269 176.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.832 ' HB ' ' HB3' ' A' ' 95' ' ' ALA . 3.6 m -107.95 143.34 18.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.681 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 5.7 t80 -123.21 139.2 54.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -174.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 124.416 1.086 . . . . 0.0 111.974 -179.929 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.832 ' HB3' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.531 0.213 0 CA-C-O 120.889 0.376 . . . . 0.0 111.335 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.41 -34.64 72.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.21 -32.31 70.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.409 ' HB3' ' CD2' ' A' ' 70' ' ' LEU . . . -75.14 -38.14 61.13 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.644 -177.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.41 -44.8 3.64 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.704 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -61.5 -24.85 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.8 0.333 . . . . 0.0 110.854 -174.844 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.0 -50.75 26.1 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-O 121.359 0.599 . . . . 0.0 110.713 175.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.577 HD23 HD23 ' A' ' 74' ' ' LEU . 14.5 mt -55.05 -39.51 69.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.95 -173.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 103' ' ' ARG . 0.7 OUTLIER -66.49 -27.65 67.96 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.849 -179.677 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 3.8 mt-10 -76.41 -7.78 55.76 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.024 0.44 . . . . 0.0 110.704 175.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 13.8 m-85 -103.65 -2.9 25.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.144 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 125.97 -12.15 7.28 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.232 -0.985 . . . . 0.0 113.685 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . 0.598 ' HZ ' ' HB3' ' A' ' 79' ' ' LEU . 23.8 m-85 -59.44 111.8 1.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.082 0.467 . . . . 0.0 110.785 -177.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -66.97 -50.86 60.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.366 -171.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.671 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 1.8 m -121.54 101.99 7.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.195 0.522 . . . . 0.0 111.312 -174.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.523 HG21 ' O ' ' A' ' 110' ' ' ILE . 1.3 tt -121.15 130.9 74.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.922 -176.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -112.77 141.76 46.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.591 -176.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.579 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 19.6 t-20 -113.09 144.21 43.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.56 ' OG ' ' HA ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -79.86 130.42 35.3 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -171.055 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -174.71 1.55 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.196 171.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.853 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 45.76 -104.14 0.06 OUTLIER Glycine 0 CA--C 1.518 0.249 0 O-C-N 123.413 0.445 . . . . 0.0 113.576 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -177.46 -163.11 28.84 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 177.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' MET . . . . . 0.656 ' HG3' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -71.93 -29.39 64.24 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.142 0.496 . . . . 0.0 109.978 176.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -33.56 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.87 178.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.904 ' HA ' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -66.95 -32.05 73.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.612 -179.006 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.681 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -61.54 -54.66 40.25 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.454 HD12 ' O ' ' A' ' 54' ' ' MET . 16.6 mt -63.55 -42.83 98.36 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.92 0.391 . . . . 0.0 111.207 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.904 ' HG2' ' HA ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -70.45 -32.86 70.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.932 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.481 ' N ' ' HG3' ' A' ' 122' ' ' GLU . 19.0 mm-40 -80.65 3.4 22.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -178.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.41 25.05 76.13 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.214 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.472 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 60.5 mt -74.24 161.7 77.12 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.634 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 35.3 Cg_endo -61.03 115.32 2.63 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.516 2.144 . . . . 0.0 111.385 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.24 150.39 51.94 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.512 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 5.7 mt -102.92 102.3 12.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.059 0.457 . . . . 0.0 110.154 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.731 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' MET . . . . . 0.555 ' HG3' ' HB2' ' B' ' 6' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' GLY . . . . . 0.747 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.24 -44.57 96.37 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.689 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.98 -32.34 72.68 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.165 0.507 . . . . 0.0 110.888 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.555 ' HB2' ' HG3' ' B' ' 3' ' ' MET . 0.4 OUTLIER -71.55 -52.52 17.73 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.438 -174.491 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . 0.747 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -83.81 -22.85 31.67 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.219 -176.185 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -53.24 -45.72 68.87 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.154 0.502 . . . . 0.0 109.989 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.26 -39.42 90.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.527 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.63 -46.74 62.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.451 0.167 . . . . 0.0 111.269 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' PHE . . . . . 0.546 ' CZ ' HD22 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -56.67 -43.17 80.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.411 0.624 . . . . 0.0 109.947 179.227 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.7 OUTLIER -66.2 -26.39 67.37 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.486 176.544 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.89 -49.35 20.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.892 0.377 . . . . 0.0 111.124 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -62.91 -50.97 68.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.129 179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.475 HG11 ' N ' ' B' ' 16' ' ' LYS . 0.5 OUTLIER -66.41 -32.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.596 -175.251 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 6.3 ttmm -66.03 -40.76 91.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.583 0.23 . . . . 0.0 110.913 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.66 -27.01 62.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.485 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.85 -32.54 63.71 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.753 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -24.95 41.2 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.462 0.648 . . . . 0.0 110.702 172.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.04 -17.11 36.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.026 -0.988 . . . . 0.0 112.317 -175.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.559 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 8.4 t0 -69.05 -25.96 64.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.901 -174.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' MET . . . . . 0.613 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 5.8 ptm -119.73 176.68 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.847 0.356 . . . . 0.0 111.772 -176.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 41.2 t -74.17 111.97 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.916 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.1 109.36 15.59 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.854 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . 0.466 HD22 ' HA ' ' B' ' 25' ' ' LEU . 0.9 OUTLIER -119.52 146.04 45.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.317 0.58 . . . . 0.0 111.02 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.38 137.81 52.05 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.289 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -48.24 -22.35 3.78 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 124.05 3.167 . . . . 0.0 114.419 -176.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 16.7 mtmm -73.26 -42.47 62.46 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.165 -0.334 . . . . 0.0 110.906 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.26 -32.89 49.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.147 0.498 . . . . 0.0 110.225 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.89 79.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.268 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' TYR . . . . . 0.637 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 78.8 t80 -66.82 -33.39 75.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 177.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.0 tptp -56.92 -50.22 73.23 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.115 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.654 ' HB2' HD11 ' B' ' 40' ' ' ILE . 0.2 OUTLIER -72.18 -26.3 62.01 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.727 177.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.417 HD11 ' HA ' ' B' ' 31' ' ' TYR . 18.4 mt -63.45 -51.04 67.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.858 0.361 . . . . 0.0 111.183 178.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.22 -31.25 67.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.395 -177.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -82.06 -38.29 25.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.822 0.344 . . . . 0.0 111.765 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -110.04 108.54 59.06 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.909 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.33 0.1 7.89 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.671 2.248 . . . . 0.0 111.759 176.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.22 -29.65 14.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.071 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.654 HD11 ' HB2' ' B' ' 33' ' ' LEU . 61.2 mt -82.63 109.43 16.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.948 177.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -102.23 143.57 31.85 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.798 -177.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' B' ' 88' ' ' PHE . 5.8 tp -100.19 127.9 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 174.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.81 HG12 ' HE2' ' B' ' 65' ' ' MET . 2.0 mt -109.13 118.3 56.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-O 121.235 0.54 . . . . 0.0 109.669 177.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.763 ' HB3' ' CE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -104.64 133.32 49.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.528 -0.76 . . . . 0.0 108.951 178.378 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.477 ' O ' HG21 ' B' ' 45' ' ' VAL . 27.6 m -131.61 99.52 3.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.034 -0.985 . . . . 0.0 109.974 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . 1.365 HH11 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -153.93 165.27 36.64 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.614 -1.175 . . . . 0.0 109.36 -176.668 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 1.556 ' CG ' ' HB3' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -66.51 129.86 94.13 Favored Pre-proline 0 C--N 1.316 -0.885 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.102 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' B' ' 52' ' ' LYS . 26.3 Cg_endo -68.72 -16.7 42.24 Favored 'Trans proline' 0 N--CA 1.474 0.349 0 C-N-CA 123.689 2.926 . . . . 0.0 114.843 -168.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.432 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . 0.4 OUTLIER -78.12 -46.62 20.19 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -173.531 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' GLU . . . . . 0.468 ' OE1' ' HE2' ' B' ' 117' ' ' MET . 1.2 tt0 -71.2 -33.53 70.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 0.0 110.365 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.53 -44.39 97.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.338 175.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' LYS . . . . . 0.474 ' HB2' ' O ' ' B' ' 48' ' ' PRO . 1.7 ttpt -63.69 -37.08 86.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.747 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -97.46 -44.85 6.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -171.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 1.9 mmm -90.28 -34.8 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.405 -0.518 . . . . 0.0 112.33 -171.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' GLY . . . . . 0.48 ' HA2' ' O ' ' B' ' 128' ' ' LEU . . . 149.72 145.05 4.05 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.077 -1.059 . . . . 0.0 113.764 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' LYS . . . . . 0.415 ' HG3' ' HB2' ' B' ' 128' ' ' LEU . 0.0 OUTLIER -133.9 165.07 39.48 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 174.67 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.11 129.37 17.11 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.576 1.518 . . . . 0.0 112.559 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . 0.598 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 13.4 t70 -90.37 95.33 10.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.447 ' CG2' ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -138.27 153.14 26.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.598 -174.191 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.404 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -71.09 -34.24 70.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.312 -176.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -132.53 79.39 1.85 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.31 0.576 . . . . 0.0 111.867 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' TYR . . . . . 0.763 ' CE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -139.08 137.62 36.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.482 176.287 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -120.7 129.09 53.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.944 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -90.29 111.74 23.04 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' MET . . . . . 0.81 ' HE2' HG12 ' B' ' 43' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.519 0 CA-C-O 120.541 0.21 . . . . 0.0 110.516 -176.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.51 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.4 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.566 ' HB2' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -45.41 -63.97 1.05 Allowed Pre-proline 0 CA--C 1.547 0.837 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -174.417 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 61.8 Cg_endo -75.24 -12.78 21.05 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.349 2.033 . . . . 0.0 113.561 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.516 ' HB3' ' HG2' ' B' ' 65' ' ' MET . 0.1 OUTLIER -89.5 2.73 54.18 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.318 -0.239 . . . . 0.0 111.169 -174.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.611 HD22 ' CD1' ' A' ' 7' ' ' PHE . 8.7 tp -72.74 -52.86 13.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.344 -177.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.13 -19.68 61.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.733 0.302 . . . . 0.0 111.498 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.65 -27.57 31.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.648 -175.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -77.95 -27.12 49.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -177.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.24 75.38 1.3 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.511 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 9.5 mt -129.59 145.23 51.5 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -128.03 138.47 33.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' PRO . . . . . 0.921 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 35.6 Cg_endo -69.21 12.48 0.28 Allowed 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.209 2.606 . . . . 0.0 114.245 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -102.77 -12.11 17.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 176.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.5 133.91 25.09 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.279 -177.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.561 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.7 Cg_exo -71.65 126.8 12.42 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.429 2.086 . . . . 0.0 110.839 175.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 6.3 m -132.11 151.88 35.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.534 -176.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.533 HG11 HD11 ' B' ' 42' ' ' LEU . 1.6 p -125.62 141.78 44.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . 0.844 ' HB ' ' HB2' ' B' ' 95' ' ' ALA . 16.6 m -107.73 141.03 23.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' PHE . . . . . 0.929 ' HZ ' ' HB2' ' B' ' 120' ' ' TRP . 8.9 t80 -119.12 141.48 48.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.034 -173.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . 0.576 ' HB2' ' O ' ' B' ' 88' ' ' PHE . 1.4 m . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 123.618 0.767 . . . . 0.0 111.754 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . 0.844 ' HB2' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.458 -0.051 0 CA-C-O 121.047 0.451 . . . . 0.0 110.625 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.52 -33.58 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.69 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.07 -29.75 70.14 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.602 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 98' ' ' ALA . . . . . 0.657 ' HB2' HG13 ' B' ' 87' ' ' VAL . . . -75.88 -56.04 5.05 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.293 0.568 . . . . 0.0 110.685 176.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 99' ' ' GLY . . . . . 0.637 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -71.74 -48.63 27.32 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.023 -0.99 . . . . 0.0 114.464 -171.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 100' ' ' LYS . . . . . 0.559 ' HB2' ' HB3' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -68.41 -33.71 74.72 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.497 -0.413 . . . . 0.0 111.107 -174.154 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 6.2 m -72.07 -36.01 69.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.656 0.265 . . . . 0.0 110.889 176.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 102' ' ' LEU . . . . . 0.579 HD21 ' CE1' ' B' ' 107' ' ' PHE . 8.9 mt -64.18 -47.75 78.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.446 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 103' ' ' ARG . . . . . 0.716 ' HB3' HG23 ' B' ' 110' ' ' ILE . 0.6 OUTLIER -65.1 -26.99 68.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.791 0.329 . . . . 0.0 110.597 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 2.9 mt-10 -73.11 -6.79 48.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.33 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -106.07 -8.37 17.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.961 0.41 . . . . 0.0 110.284 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 109.28 60.92 0.52 Allowed Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.49 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 107' ' ' PHE . . . . . 0.579 ' CE1' HD21 ' B' ' 102' ' ' LEU . 1.3 m-85 -104.48 139.61 39.15 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 176.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 -77.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.498 0.499 . . . . 0.0 111.522 -175.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.5 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 2.7 m -129.94 109.05 10.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.141 0.495 . . . . 0.0 111.238 -178.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 110' ' ' ILE . . . . . 0.716 HG23 ' HB3' ' B' ' 103' ' ' ARG . 2.3 tt -115.77 130.33 70.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.672 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -114.6 146.85 40.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.45 -177.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.613 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 7.0 t-20 -111.27 138.4 47.79 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 172.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.505 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 65.5 m -87.83 112.64 22.68 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -62.06 145.76 52.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.966 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.75 -110.6 3.32 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.434 -0.889 . . . . 0.0 111.624 -174.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 116' ' ' GLY . . . . . 0.432 ' H ' ' HB2' ' B' ' 119' ' ' LYS . . . 160.37 -162.5 33.35 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 117' ' ' MET . . . . . 0.468 ' HE2' ' OE1' ' B' ' 50' ' ' GLU . 0.2 OUTLIER -58.88 -36.19 74.24 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.011 0.434 . . . . 0.0 110.699 179.401 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.46 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 3.5 t70 -61.85 -35.06 77.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.406 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 119' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -74.01 -33.42 63.78 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.806 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 120' ' ' TRP . . . . . 0.929 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 25.9 t-105 -57.6 -52.96 63.28 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.59 -39.84 95.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.024 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -70.67 -35.15 72.7 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 112.341 0.496 . . . . 0.0 112.341 -174.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 19.1 mm-40 -74.83 -4.24 36.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.813 0.34 . . . . 0.0 110.519 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.07 23.85 73.23 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.705 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.494 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 72.4 mt -76.67 160.78 76.25 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . 0.494 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 29.5 Cg_endo -61.39 108.26 0.58 Allowed 'Trans proline' 0 C--O 1.236 0.397 0 C-N-CA 122.35 2.033 . . . . 0.0 111.221 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.71 156.01 43.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.714 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 128' ' ' LEU . . . . . 0.598 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 8.4 mt . . . . . 0 C--N 1.318 -0.796 0 CA-C-O 120.897 0.38 . . . . 0.0 110.398 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.827 0.346 . . . . 0.0 111.304 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.649 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -49.98 -23.45 5.48 Favored Glycine 0 CA--C 1.522 0.493 0 CA-C-N 115.127 -0.942 . . . . 0.0 114.061 -174.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -73.78 -32.68 63.9 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -64.07 -47.38 80.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -173.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.649 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.3 p90 -91.1 -23.19 20.38 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.967 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' B' ' 75' ' ' ALA . 2.9 t70 -53.59 -54.92 30.69 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.852 0.358 . . . . 0.0 110.629 -178.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.96 -42.24 89.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.526 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.506 ' HB ' ' CZ ' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -68.91 -44.98 72.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.41 -178.505 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.55 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.6 OUTLIER -57.93 -47.41 82.94 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.253 0.549 . . . . 0.0 110.074 -179.377 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.499 ' HD2' ' HD2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -64.76 -26.29 68.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.107 177.127 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.13 -40.78 64.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.883 0.373 . . . . 0.0 111.392 178.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -72.36 -49.88 30.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.793 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 t -62.07 -36.47 74.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.303 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.499 ' HD2' ' HD2' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -64.14 -30.05 71.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.566 0.222 . . . . 0.0 111.49 179.558 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.02 68.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 110.687 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.62 -30.13 62.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.397 177.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.721 ' HG2' ' HE2' ' A' ' 24' ' ' MET . 13.5 mtpp -77.02 -24.15 52.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.528 0.68 . . . . 0.0 110.302 172.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.86 35.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.981 -1.008 . . . . 0.0 111.234 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -71.03 -24.21 62.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.787 -175.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.749 ' HE2' HG12 ' A' ' 110' ' ' ILE . 14.5 mtp -121.23 178.47 4.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.691 0.282 . . . . 0.0 111.158 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.7 112.45 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.541 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.721 ' HE2' ' HG2' ' A' ' 19' ' ' LYS . 0.9 OUTLIER -78.28 103.19 8.06 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.174 -176.891 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.433 HD21 ' HA ' ' A' ' 25' ' ' LEU . 3.2 mt -112.08 139.62 47.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.979 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.39 147.77 57.35 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.897 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.532 ' HB3' ' CE3' ' A' ' 120' ' ' TRP . 26.9 Cg_exo -34.18 -56.42 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.536 3.49 . . . . 0.0 114.394 -175.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.594 ' HG3' ' OE1' ' A' ' 123' ' ' GLU . 4.4 mttp -63.37 -37.82 88.76 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.51 -34.91 76.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 0.0 110.343 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.612 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -71.79 -47.37 53.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.518 176.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.577 ' HA ' HD11 ' A' ' 34' ' ' LEU . 82.6 t80 -60.02 -32.25 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.351 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.73 -51.87 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.494 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -74.31 -27.16 60.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.033 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.638 HD23 ' HB2' ' A' ' 42' ' ' LEU . 81.6 mt -62.98 -55.35 26.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.989 0.423 . . . . 0.0 111.263 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.662 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -75.85 -22.27 56.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.071 -173.601 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.402 ' HG2' ' ND2' ' A' ' 37' ' ' ASN . 0.3 OUTLIER -93.72 -24.29 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.883 0.373 . . . . 0.0 110.791 -177.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.409 ' C ' ' H ' ' A' ' 39' ' ' ASP . 0.8 OUTLIER -129.49 94.11 33.54 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.288 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -68.81 9.58 0.44 Allowed 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.73 2.287 . . . . 0.0 113.103 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.409 ' H ' ' C ' ' A' ' 37' ' ' ASN . 0.2 OUTLIER -91.12 -29.17 17.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.618 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 26.2 mt -83.16 100.91 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.458 173.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.408 ' O ' ' HA ' ' A' ' 85' ' ' VAL . 9.9 m -92.61 146.8 23.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.401 -175.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.638 ' HB2' HD23 ' A' ' 34' ' ' LEU . 8.3 tp -100.74 128.3 46.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 173.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.1 mt -109.59 118.15 56.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.442 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.836 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -102.39 124.02 47.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.225 0.536 . . . . 0.0 109.869 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -109.26 96.68 4.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.429 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.687 ' NE ' ' HA ' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -150.06 163.33 38.45 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.294 -176.32 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.557 ' HB3' ' HB2' ' A' ' 50' ' ' GLU . 6.0 t70 -75.91 137.28 69.6 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.786 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -59.6 -29.95 91.13 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.677 2.251 . . . . 0.0 112.367 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.23 -36.23 47.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.809 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.557 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -65.88 -35.79 81.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 173.251 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.841 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.0 OUTLIER -65.51 -33.67 76.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.734 177.232 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -42.08 61.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.648 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.06 -45.55 23.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -175.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.1 mtp -101.41 -34.7 9.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 116.41 179.14 18.05 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.56 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.841 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -148.23 155.7 43.09 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.108 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.47 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 23.4 Cg_endo -65.52 137.51 50.91 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.413 2.076 . . . . 0.0 112.598 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.685 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t0 -111.95 84.72 2.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.229 0.537 . . . . 0.0 110.595 178.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 62' ' ' TYR . 13.0 m -112.02 163.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.005 176.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.662 ' HD2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.83 -42.94 72.53 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.634 0.584 . . . . 0.0 111.59 -177.546 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -120.47 76.76 1.21 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.724 0.773 . . . . 0.0 111.206 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.836 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 2.4 t80 -116.99 125.97 52.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.431 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -122.02 123.53 41.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.124 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.433 ' HB2' ' OH ' ' A' ' 62' ' ' TYR . 11.4 t-160 -94.64 132.93 38.85 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.609 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.662 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.66 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.618 HD22 ' CZ ' ' B' ' 11' ' ' PHE . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.489 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.849 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.8 mp0 -49.05 -60.1 5.28 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.708 -177.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.849 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 13.8 Cg_exo -71.26 -18.09 30.54 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.248 1.966 . . . . 0.0 113.124 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.495 HD21 ' HA ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -88.69 -15.45 34.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.616 0.246 . . . . 0.0 111.414 -178.434 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.454 HD12 HD13 ' A' ' 70' ' ' LEU . 3.3 tp -57.88 -52.8 63.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.239 0.543 . . . . 0.0 110.507 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' B' ' 4' ' ' GLY . . . -68.14 -29.4 68.29 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.651 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.509 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 1.6 mtpt -75.69 -30.39 59.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.072 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.9 m -78.85 -38.01 38.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.92 90.5 2.13 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.389 177.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.3 mt -134.23 148.54 50.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.848 0.356 . . . . 0.0 111.084 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -134.45 138.25 29.67 Favored Pre-proline 0 C--N 1.328 -0.331 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.358 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 44.4 Cg_exo -63.88 -1.06 3.07 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.368 2.712 . . . . 0.0 114.608 -172.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -97.1 -5.88 36.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.039 0.447 . . . . 0.0 110.15 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -92.82 116.0 65.8 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.295 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.618 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 17.1 Cg_exo -63.27 141.44 82.1 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.436 2.09 . . . . 0.0 110.411 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.649 HG22 HD13 ' A' ' 110' ' ' ILE . 0.5 OUTLIER -138.58 146.28 26.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 121.091 0.472 . . . . 0.0 111.384 -175.246 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.507 HG21 ' N ' ' A' ' 87' ' ' VAL . 1.5 p -119.91 142.9 33.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 172.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.507 ' N ' HG21 ' A' ' 86' ' ' VAL . 5.3 m -102.85 127.43 56.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.038 0.447 . . . . 0.0 110.732 -177.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.573 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 3.7 t80 -113.47 151.95 30.78 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.5 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' CYS . . . . . 0.463 ' SG ' ' HB1' ' A' ' 95' ' ' ALA . 5.4 p . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.526 -176.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.463 ' HB1' ' SG ' ' A' ' 89' ' ' CYS . . . . . . . . 0 CA--C 1.519 -0.231 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.28 -36.75 76.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.132 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -67.17 -36.8 82.56 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.824 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.628 ' HA ' ' HZ ' ' B' ' 11' ' ' PHE . . . -74.47 -47.96 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.46 . . . . 0.0 110.644 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.584 ' HA2' HD12 ' A' ' 110' ' ' ILE . . . -69.77 -52.99 17.38 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.666 -0.697 . . . . 0.0 113.626 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.564 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.39 -30.7 71.79 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.66 -0.318 . . . . 0.0 111.372 -175.21 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.453 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 47.3 m -73.05 -37.95 66.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.362 . . . . 0.0 110.846 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.437 HD21 ' HA ' ' A' ' 102' ' ' LEU . 12.8 mt -64.2 -46.11 85.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.153 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.37 -26.49 68.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 110.349 177.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -72.98 -9.21 58.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.491 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.42 ' HH ' ' C ' ' B' ' 10' ' ' THR . 20.9 m-85 -106.03 -18.46 14.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 0.0 110.6 177.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 117.04 54.95 0.31 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.875 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -94.47 167.92 11.2 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.711 -0.287 . . . . 0.0 110.261 176.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.528 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.4 tttt -77.17 -98.37 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.83 0.348 . . . . 0.0 111.303 -176.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.528 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -107.04 121.71 45.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.524 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.749 HG12 ' HE2' ' A' ' 22' ' ' MET . 1.0 OUTLIER -121.91 126.77 74.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.49 0.662 . . . . 0.0 111.477 -174.775 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.47 147.53 44.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.254 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.636 ' HB3' ' HE1' ' A' ' 24' ' ' MET . 12.9 t-20 -117.71 144.78 44.94 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.5 131.3 36.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.473 0.654 . . . . 0.0 111.348 -172.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 114' ' ' GLU . 3.8 tp10 -98.2 3.8 48.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.511 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.82 -92.9 2.28 Favored Glycine 0 N--CA 1.443 -0.84 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.203 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . 0.41 ' HA2' ' O ' ' A' ' 89' ' ' CYS . . . 141.32 161.44 8.71 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' MET . . . . . 0.545 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -56.97 -41.38 78.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.115 0.457 . . . . 0.0 110.954 -176.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.37 -27.61 65.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.424 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -72.65 -32.49 65.9 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.761 176.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.573 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 41.5 t-105 -56.99 -47.28 81.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.44 -38.22 86.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.753 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 119' ' ' LYS . 64.6 mt-10 -65.67 -37.3 86.12 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.558 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.594 ' OE1' ' HG3' ' A' ' 28' ' ' LYS . 15.5 mt-10 -83.58 4.08 29.81 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 70.48 28.8 70.61 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.344 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 125' ' ' LEU . 71.7 mt -85.83 158.88 55.84 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-O 120.516 0.198 . . . . 0.0 110.513 -178.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 19.7 Cg_endo -57.25 119.06 6.06 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.415 2.743 . . . . 0.0 112.564 -177.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.4 m -133.19 158.31 43.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.032 0.444 . . . . 0.0 111.459 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.685 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 1.1 mt -113.97 111.31 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.295 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 . . . . . 0 C--N 1.319 -0.742 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.88 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' MET . . . . . 0.508 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mmm . . . . . 0 CA--C 1.52 -0.19 0 CA-C-O 120.673 0.273 . . . . 0.0 111.469 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' GLY . . . . . 0.691 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.45 -36.26 76.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.474 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.67 -32.29 73.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.857 0.361 . . . . 0.0 111.027 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -63.51 -48.12 78.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.994 -176.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . 0.691 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.7 p90 -90.62 -22.46 21.2 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.192 -177.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . 0.404 ' HB2' ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -53.67 -47.43 70.41 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.986 0.422 . . . . 0.0 110.756 -177.153 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.9 -43.6 98.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.107 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' THR . . . . . 0.42 ' C ' ' HH ' ' A' ' 105' ' ' TYR . 0.2 OUTLIER -65.45 -42.57 92.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.522 -178.825 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' PHE . . . . . 0.628 ' HZ ' ' HA ' ' A' ' 98' ' ' ALA . 0.2 OUTLIER -55.59 -50.41 70.16 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.006 0.431 . . . . 0.0 111.107 -176.797 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' LYS . . . . . 0.45 ' HD2' ' HA ' ' B' ' 12' ' ' LYS . 20.9 tptt -69.68 -23.66 63.48 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.191 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.71 75.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -71.43 -50.14 34.78 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.229 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.73 -34.59 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.242 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -63.07 -31.97 73.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.529 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.32 -26.21 64.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 0.0 111.193 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.27 -45.6 83.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.702 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.521 ' HB2' ' HE2' ' B' ' 24' ' ' MET . 1.1 ptmt -75.3 -21.01 58.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.099 0.476 . . . . 0.0 111.067 176.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -17.14 60.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.543 -178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.4 -19.73 60.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.92 0.391 . . . . 0.0 111.554 -177.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' MET . . . . . 0.712 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 2.6 ptm -120.86 -179.54 4.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.758 0.313 . . . . 0.0 110.916 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.34 106.71 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.109 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' MET . . . . . 0.521 ' HE2' ' HB2' ' B' ' 19' ' ' LYS . 0.1 OUTLIER -74.41 103.56 4.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.186 0.517 . . . . 0.0 110.267 178.72 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 1.5 mt -116.0 141.35 48.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.885 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.45 144.37 43.09 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.374 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.525 ' HB2' HD13 ' B' ' 125' ' ' LEU . 3.9 Cg_exo -40.68 -34.13 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 124.814 3.676 . . . . 0.0 115.402 -174.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.517 ' HE3' ' HB3' ' B' ' 123' ' ' GLU . 1.5 mttt -74.47 -44.04 53.38 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.672 0.669 . . . . 0.0 111.266 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.24 -33.38 75.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.247 0.546 . . . . 0.0 110.15 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.79 52.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.821 177.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' TYR . . . . . 0.54 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.6 t80 -63.96 -32.9 74.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.522 0.201 . . . . 0.0 111.037 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.417 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -54.59 -53.73 50.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.898 -179.741 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.619 ' HB2' HD11 ' B' ' 40' ' ' ILE . 0.2 OUTLIER -74.78 -27.69 60.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.156 179.086 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.54 ' HB2' ' HA ' ' B' ' 31' ' ' TYR . 6.2 mt -62.45 -56.59 16.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.002 0.429 . . . . 0.0 111.418 -178.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -77.36 -21.71 52.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.222 -174.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.417 ' HB3' ' O ' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -91.05 -27.94 18.28 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.578 -177.447 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -120.42 93.31 48.21 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . 0.446 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 31.5 Cg_exo -64.68 3.64 0.84 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 123.229 2.619 . . . . 0.0 114.067 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' B' ' 83' ' ' LYS . 20.4 t70 -92.18 -22.45 19.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.619 HD11 ' HB2' ' B' ' 33' ' ' LEU . 53.5 mt -78.31 107.66 10.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.751 174.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.28 145.05 26.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.36 -175.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.589 HD12 ' HB2' ' B' ' 88' ' ' PHE . 11.1 tp -104.76 125.49 50.89 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.1 mp -102.33 116.61 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 175.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.764 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.72 121.5 41.76 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -176.445 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.39 96.48 4.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . 0.613 ' NE ' ' HA ' ' B' ' 46' ' ' ARG . 1.7 tpm_? -150.59 155.91 40.34 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.376 -175.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.1 136.55 79.29 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.72 -177.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 -30.57 91.09 Favored 'Trans proline' 0 N--CA 1.466 -0.126 0 C-N-CA 122.742 2.294 . . . . 0.0 112.513 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -73.24 -42.88 62.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.949 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -33.2 75.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.181 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.727 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 tp -62.11 -33.87 75.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.629 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -70.2 -40.28 74.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.77 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.67 -41.49 13.34 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 3.1 mtp -97.65 -34.14 11.05 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.655 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 113.07 177.95 19.55 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.205 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' LYS . . . . . 0.727 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -147.24 160.72 38.81 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . 0.463 ' HB2' HG23 ' B' ' 59' ' ' VAL . 11.9 Cg_endo -60.53 130.52 33.93 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.019 1.813 . . . . 0.0 112.887 -178.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -92.34 97.69 11.03 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.466 ' CG2' ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -139.83 159.41 27.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.29 -175.879 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -28.29 36.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.255 -176.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.446 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 13.4 p-10 -130.02 69.98 1.44 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.342 0.591 . . . . 0.0 111.633 -174.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' TYR . . . . . 0.764 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -136.45 142.53 43.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.274 176.696 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.685 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 34.2 mttm -127.69 121.9 31.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 -177.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -76.93 129.23 35.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.529 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' MET . . . . . 0.873 ' HB3' ' HB2' ' B' ' 70' ' ' LEU . 14.6 mmt . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.721 174.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.873 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.467 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.587 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.89 -57.08 11.03 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.09 -175.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . 0.464 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 9.6 Cg_exo -71.63 -17.67 29.57 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.21 1.94 . . . . 0.0 112.35 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.51 -22.81 40.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.878 0.37 . . . . 0.0 110.131 177.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.537 HD22 ' CD1' ' A' ' 7' ' ' PHE . 4.6 tp -57.19 -52.02 66.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.31 177.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.41 ' HB3' ' HB2' ' A' ' 8' ' ' ASP . . . -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.441 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -71.46 -25.75 62.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.904 0.383 . . . . 0.0 111.019 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' SER . . . . . 0.685 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 47.7 m -78.19 -41.6 34.1 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.224 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.16 60.26 1.33 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.65 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 7.6 mt -94.72 151.15 19.51 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' B' ' 83' ' ' LYS . 0.0 OUTLIER -122.26 130.52 24.66 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' PRO . . . . . 0.428 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 59.5 Cg_exo -60.63 -6.95 6.39 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.697 2.931 . . . . 0.0 114.935 -171.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -90.6 -7.51 52.57 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.827 -0.545 . . . . 0.0 110.389 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 4.3 mttp -82.02 126.09 75.75 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.607 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.547 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 5.9 Cg_exo -72.24 122.16 8.13 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.192 1.928 . . . . 0.0 109.969 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.462 ' CG2' HD13 ' B' ' 110' ' ' ILE . 13.0 m -127.62 153.21 36.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.101 0.477 . . . . 0.0 111.565 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.48 HG11 HD11 ' B' ' 42' ' ' LEU . 1.4 p -124.28 143.05 39.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 176.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 m -106.43 122.94 60.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.8 0.333 . . . . 0.0 110.513 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' PHE . . . . . 0.767 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -91.69 123.58 35.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.852 -178.845 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -168.621 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.211 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 96' ' ' ALA . . . . . 0.416 ' O ' ' HB3' ' B' ' 100' ' ' LYS . . . -59.57 -34.29 72.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.172 177.246 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -72.94 -35.23 66.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.811 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 98' ' ' ALA . . . . . 0.55 ' HA ' ' HZ ' ' A' ' 11' ' ' PHE . . . -71.4 -44.18 65.42 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.034 0.445 . . . . 0.0 110.561 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 99' ' ' GLY . . . . . 0.529 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -76.02 -51.47 6.91 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.424 -177.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 100' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' B' ' 104' ' ' GLU . 0.0 OUTLIER -62.8 -31.77 72.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.907 0.353 . . . . 0.0 111.268 -174.791 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 10.8 m -73.03 -35.78 66.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.735 0.302 . . . . 0.0 110.98 175.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 102' ' ' LEU . . . . . 0.547 HD21 ' CE1' ' B' ' 107' ' ' PHE . 6.8 mt -62.65 -49.98 73.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.144 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 103' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -64.44 -27.01 68.7 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.874 0.368 . . . . 0.0 110.409 178.208 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' B' ' 100' ' ' LYS . 4.7 tt0 -71.14 -8.42 53.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.029 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . 0.506 ' CZ ' ' HB ' ' A' ' 10' ' ' THR . 21.4 m-30 -112.01 -8.09 14.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.778 0.323 . . . . 0.0 111.117 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.66 49.7 0.34 Allowed Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.127 -1.035 . . . . 0.0 112.98 174.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 107' ' ' PHE . . . . . 0.547 ' CE1' HD21 ' B' ' 102' ' ' LEU . 2.0 m-85 -99.43 149.26 23.38 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 108' ' ' LYS . . . . . 0.463 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -63.01 -91.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.42 -175.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.463 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.9 OUTLIER -116.36 122.25 44.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.34 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 110' ' ' ILE . . . . . 0.555 HG12 ' HE2' ' B' ' 22' ' ' MET . 1.2 tt -120.22 129.13 75.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.275 0.559 . . . . 0.0 111.285 -175.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 111' ' ' TYR . . . . . 0.401 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 1.2 m-85 -116.59 148.68 40.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.067 -177.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.712 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 10.3 t-20 -115.52 143.09 45.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.45 ' HB3' ' HA ' ' B' ' 88' ' ' PHE . 13.7 p -80.97 133.97 35.61 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.425 0.631 . . . . 0.0 111.511 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -86.18 123.34 31.35 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.507 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . 0.711 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 97.2 -79.29 0.67 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.673 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 116' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' B' ' 119' ' ' LYS . . . 150.27 -175.89 29.13 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.915 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 117' ' ' MET . . . . . 0.721 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -61.87 -27.47 68.81 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.933 0.493 . . . . 0.0 111.697 -176.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.422 ' O ' ' HG3' ' B' ' 122' ' ' GLU . 7.5 p-10 -67.85 -24.29 65.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 119' ' ' LYS . . . . . 0.711 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -72.18 -32.86 67.2 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.783 178.273 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 120' ' ' TRP . . . . . 0.767 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 23.7 t-105 -55.57 -48.77 74.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.956 0.407 . . . . 0.0 109.973 176.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -37.76 87.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.756 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.434 ' HB2' ' HA ' ' B' ' 119' ' ' LYS . 21.0 mt-10 -67.9 -41.26 82.98 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -176.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . 0.664 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 3.9 mm-40 -74.02 -7.84 53.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.342 . . . . 0.0 110.992 -178.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.28 25.95 58.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.29 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.561 ' HG ' ' HB2' ' B' ' 123' ' ' GLU . 58.9 mt -80.44 159.97 68.57 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.56 0.219 . . . . 0.0 110.516 -178.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 18.5 Cg_endo -56.81 116.89 3.52 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.057 2.505 . . . . 0.0 112.121 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -126.86 149.18 49.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.461 -177.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.32 -0.685 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.252 0 CA-C-O 120.753 0.311 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.752 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -55.7 -29.9 55.3 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.95 -177.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -39.81 79.58 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.799 0.333 . . . . 0.0 110.665 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -66.98 -58.45 4.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.562 -174.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.752 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 3.4 p90 -68.09 -25.32 65.27 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.975 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.25 -50.78 64.11 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.47 -45.34 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.787 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -47.53 77.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.796 0.331 . . . . 0.0 110.993 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.464 ' CD1' ' HB3' ' B' ' 71' ' ' GLU . 0.7 OUTLIER -57.12 -42.86 81.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.282 0.563 . . . . 0.0 109.787 179.027 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.24 -29.27 70.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.596 177.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.9 54.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.523 -178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -72.41 -49.38 34.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.027 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 t -60.51 -41.16 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -65.87 -27.6 68.34 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.65 -26.08 68.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.062 0.458 . . . . 0.0 111.099 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.15 -31.58 72.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.423 -178.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.49 ' HD2' ' SD ' ' A' ' 24' ' ' MET . 2.4 pttt -75.03 -20.18 59.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.908 0.385 . . . . 0.0 111.614 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -23.55 57.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.418 -177.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -85.61 4.56 35.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -175.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.526 ' HE3' HG23 ' A' ' 87' ' ' VAL . 1.0 OUTLIER -145.56 162.77 36.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.65 0.262 . . . . 0.0 110.829 178.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 20.8 t -77.29 113.01 15.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.811 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.49 ' SD ' ' HD2' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.26 112.99 17.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.487 179.733 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.489 HD21 ' HA ' ' A' ' 25' ' ' LEU . 1.0 OUTLIER -124.62 145.28 49.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.086 0.469 . . . . 0.0 110.52 -178.57 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.36 141.45 36.92 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.168 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.11 -22.72 5.54 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 124.07 3.18 . . . . 0.0 114.997 -174.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.502 ' HD2' ' HA ' ' A' ' 28' ' ' LYS . 2.1 mmmm -73.65 -44.14 57.63 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.825 -0.547 . . . . 0.0 110.891 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.559 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 10.5 t0 -72.7 -37.29 67.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.853 176.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.48 -46.72 84.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.15 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.76 ' HH ' ' HG3' ' A' ' 126' ' ' PRO . 80.4 t80 -63.63 -42.8 98.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.804 -177.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -66.45 -41.54 88.97 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.813 -173.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 29' ' ' ASP . 0.3 OUTLIER -72.35 -27.38 62.38 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.598 176.082 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' A' ' 42' ' ' LEU . 1.9 mt -59.1 -50.56 73.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.767 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -76.26 -34.67 59.16 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.159 -177.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -70.47 -22.73 62.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.613 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -115.81 140.28 25.95 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-O 121.06 0.457 . . . . 0.0 111.659 -177.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.82 -9.4 10.93 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.778 2.318 . . . . 0.0 111.579 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.477 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -92.34 -67.02 0.88 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.299 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.751 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 52.3 mt -41.97 102.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.439 -175.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.511 ' HA ' ' HB2' ' A' ' 61' ' ' ASN . 26.4 m -101.85 145.09 29.68 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.271 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.697 ' HB2' HD12 ' A' ' 34' ' ' LEU . 18.1 tp -104.16 127.18 51.74 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.567 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 4.5 mt -106.69 114.57 46.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.788 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -100.41 135.78 41.31 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.627 -177.671 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -114.68 96.77 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 121.994 0.902 . . . . 0.0 109.809 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.652 ' NE ' ' HA ' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -143.4 142.52 31.27 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.611 177.468 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -71.94 140.34 83.36 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -174.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.401 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 1.1 Cg_endo -52.76 -27.41 34.02 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 123.585 2.857 . . . . 0.0 114.362 -168.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' B' ' 49' ' ' ASP . 0.7 OUTLIER -79.92 -31.62 40.11 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.903 178.403 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -36.92 72.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.982 0.42 . . . . 0.0 110.105 176.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 46' ' ' ARG . 1.6 tp -60.65 -33.9 73.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.416 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 48' ' ' PRO . 23.2 mttt -70.79 -38.59 73.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.261 177.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.83 -48.02 19.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.548 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 21.8 mmm -102.64 -34.02 9.23 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.556 -173.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 121.61 179.63 16.06 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.299 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.484 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -132.81 150.98 77.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.431 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 37.9 Cg_exo -62.34 134.91 50.93 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.514 2.143 . . . . 0.0 113.021 -176.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.469 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 26.9 t70 -101.26 92.35 4.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.699 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.553 HG23 ' HB2' ' A' ' 62' ' ' TYR . 5.3 m -133.63 159.31 42.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.068 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -57.35 -41.42 80.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.303 -177.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 41' ' ' THR . 0.1 OUTLIER -121.4 82.33 1.92 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.745 -177.305 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.788 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 3.2 t80 -120.31 125.94 49.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.567 ' O ' ' HA ' ' A' ' 43' ' ' ILE . 11.3 mttm -122.13 120.62 34.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.016 0.436 . . . . 0.0 110.123 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.436 ' HD2' ' O ' ' A' ' 44' ' ' ASP . 12.9 t-160 -88.24 128.32 35.46 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.233 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.5 ' HE2' HG12 ' A' ' 43' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.65 0 CA-C-O 121.075 0.465 . . . . 0.0 109.761 175.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.579 HD22 ' CZ ' ' B' ' 11' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.256 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.885 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.1 mt-10 -47.35 -62.08 2.36 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.162 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.885 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 3.4 Cg_exo -75.12 -17.36 19.36 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.493 2.129 . . . . 0.0 113.711 178.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.0 -27.51 19.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -173.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -28.84 66.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.23 0.538 . . . . 0.0 110.384 -177.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.91 -33.26 57.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.224 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . 0.646 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 11.4 mttt -62.69 -29.77 70.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.86 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -41.07 24.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.695 0.283 . . . . 0.0 110.874 -177.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.49 52.07 2.07 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.582 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.408 ' HB3' ' HZ ' ' A' ' 107' ' ' PHE . 3.5 mt -75.81 143.58 41.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.407 0.146 . . . . 0.0 110.636 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.465 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -114.19 136.06 22.21 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.665 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 80' ' ' ASP . 25.6 Cg_exo -69.57 1.01 4.68 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.842 2.361 . . . . 0.0 114.06 -172.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.627 ' HA ' ' HD2' ' A' ' 108' ' ' LYS . 3.9 mt-10 -99.89 -7.1 25.7 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 121.996 -0.44 . . . . 0.0 110.715 178.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.443 ' HZ2' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -84.19 118.65 71.77 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.277 177.485 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.751 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 8.4 Cg_exo -67.79 108.86 1.76 Allowed 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.45 2.1 . . . . 0.0 110.16 174.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.473 HG11 ' HB ' ' A' ' 41' ' ' THR . 9.0 m -114.64 154.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.292 0.568 . . . . 0.0 111.576 -172.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.657 HG11 HD11 ' A' ' 42' ' ' LEU . 1.5 p -123.85 142.56 40.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.264 177.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.823 ' HB ' ' HB3' ' A' ' 95' ' ' ALA . 6.0 m -108.46 126.09 65.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.764 ' O ' ' HB2' ' A' ' 89' ' ' CYS . 3.7 t80 -100.83 126.21 47.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.947 -0.569 . . . . 0.0 112.062 -171.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' CYS . . . . . 0.764 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.964 0 O-C-N 124.957 1.411 . . . . 0.0 110.934 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.823 ' HB3' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.463 0.197 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.95 -29.57 60.36 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.16 -34.49 71.01 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.829 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.89 61.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.915 0.388 . . . . 0.0 110.749 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.42 -53.23 3.91 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.945 -175.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.426 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -61.49 -33.39 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 122.545 -0.385 . . . . 0.0 111.763 -172.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.426 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 3.5 m -71.55 -36.39 70.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 110.921 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 15.0 mt -69.92 -44.2 70.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.568 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.523 ' HB3' HG23 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -63.91 -31.51 72.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.75 0.309 . . . . 0.0 110.735 -179.037 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.09 -5.22 50.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.262 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -103.41 -10.51 18.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.052 177.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.21 1.27 3.24 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 119.753 -1.213 . . . . 0.0 113.93 174.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . 0.516 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 8.0 m-85 -67.69 136.82 54.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.212 0.506 . . . . 0.0 110.403 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.627 ' HD2' ' HA ' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -67.12 -81.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.715 -174.327 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.416 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -112.19 113.59 25.92 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.825 -177.106 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.523 HG23 ' HB3' ' A' ' 103' ' ' ARG . 0.7 OUTLIER -117.23 127.7 74.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.212 0.529 . . . . 0.0 110.479 -179.67 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.524 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 13.6 m-85 -112.69 145.0 41.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.996 -176.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.452 ' HA ' HG21 ' A' ' 87' ' ' VAL . 9.5 t-20 -112.0 136.68 51.03 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.532 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 16.4 m -91.73 117.63 29.93 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -55.94 121.6 9.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.733 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 86.84 -108.34 3.32 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.983 -177.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . 0.464 ' CA ' ' HA ' ' A' ' 89' ' ' CYS . . . 159.06 -154.83 25.9 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.034 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' MET . . . . . 0.434 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 16.7 ttp -50.67 -33.65 23.44 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.844 0.457 . . . . 0.0 111.748 -177.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.526 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 27.0 t70 -58.43 -40.37 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.084 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -73.96 -31.94 63.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.632 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.725 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 22.5 t-105 -59.51 -53.86 53.27 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' A' ' 121' ' ' LEU . 7.0 mt -65.23 -38.91 91.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.95 177.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.526 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -66.21 -44.8 82.84 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.707 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -81.78 20.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -175.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 65.66 24.8 71.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.251 -0.5 . . . . 0.0 113.153 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 125' ' ' LEU . 17.6 mt -83.44 152.05 63.37 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.852 0.358 . . . . 0.0 110.702 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.76 ' HG3' ' HH ' ' A' ' 31' ' ' TYR . 33.8 Cg_endo -66.01 118.71 5.73 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.79 2.326 . . . . 0.0 112.835 -176.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.76 149.84 42.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.434 175.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.61 124.9 48.99 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.514 -177.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--N 1.323 -0.583 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.558 179.489 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.276 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' GLY . . . . . 0.608 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.14 -35.21 63.93 Favored Glycine 0 C--O 1.224 -0.476 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.921 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -33.61 58.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.841 0.353 . . . . 0.0 111.258 178.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -68.19 -56.46 8.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . 0.608 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.9 OUTLIER -74.46 -22.27 59.18 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.583 -177.498 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -53.11 -50.1 65.15 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.819 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.21 -38.56 77.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.428 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -46.4 64.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 0.0 110.619 178.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' PHE . . . . . 0.579 ' CZ ' HD22 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -56.01 -48.85 75.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.451 -179.158 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' LYS . . . . . 0.619 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -62.47 -26.13 68.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.534 179.08 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.7 -44.4 56.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.068 0.461 . . . . 0.0 111.409 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.3 -49.83 31.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.902 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.407 HG22 ' CE1' ' B' ' 11' ' ' PHE . 1.9 t -64.09 -34.27 67.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.319 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . 0.619 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -64.02 -27.89 69.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.552 0.215 . . . . 0.0 111.345 178.747 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -25.57 68.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.94 0.4 . . . . 0.0 110.887 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.65 -32.5 64.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.882 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -78.15 -23.08 47.86 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.481 0.658 . . . . 0.0 110.366 171.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.58 -18.88 58.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.803 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -79.89 -2.29 42.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.282 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' MET . . . . . 0.595 ' HE2' ' HA3' ' B' ' 99' ' ' GLY . 1.0 OUTLIER -139.63 172.72 12.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 111.076 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 17.6 t -82.09 112.44 19.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.729 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' MET . . . . . 0.615 ' SD ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -72.7 100.47 2.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.764 -0.198 . . . . 0.0 110.524 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' B' ' 113' ' ' SER . 1.2 mt -117.68 134.2 55.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.146 0.498 . . . . 0.0 110.449 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.38 152.33 70.25 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.521 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 6.9 Cg_endo -51.72 -20.93 10.3 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 123.661 2.907 . . . . 0.0 114.701 -174.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.414 ' HD2' ' HA ' ' B' ' 28' ' ' LYS . 5.8 mmmm -75.44 -48.01 24.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.102 0.477 . . . . 0.0 110.975 176.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.81 -31.37 64.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.689 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.14 -43.92 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.63 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' TYR . . . . . 0.446 ' HA ' HD11 ' B' ' 34' ' ' LEU . 89.3 t80 -68.55 -31.7 71.11 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.065 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -53.7 55.15 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.054 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.58 ' HB2' HD11 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -74.46 -27.33 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.134 179.779 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.446 HD11 ' HA ' ' B' ' 31' ' ' TYR . 5.7 mt -57.74 -55.0 40.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.06 -177.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . 0.859 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 15.6 mm100 -74.59 -19.03 60.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.907 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -35.08 15.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.754 0.312 . . . . 0.0 111.478 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 1.2 m-80 -92.43 127.33 49.09 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -76.76 -9.55 18.33 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.632 2.221 . . . . 0.0 111.285 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.402 ' CG ' ' HG3' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -90.99 -69.45 0.73 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 177.168 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.765 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 53.6 mt -44.11 109.75 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.833 -175.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.424 HG23 ' HG3' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -106.49 145.75 31.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.003 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.649 HD13 ' HB2' ' B' ' 88' ' ' PHE . 13.9 tp -102.44 124.41 47.97 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 96.4 mt -103.84 113.11 39.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.806 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.91 137.43 39.3 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.221 -177.434 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -115.34 97.19 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 121.87 0.843 . . . . 0.0 110.04 175.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . 0.716 ' HG2' ' HE1' ' B' ' 117' ' ' MET . 0.8 OUTLIER -148.41 134.29 19.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.423 177.715 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.83 147.63 96.2 Favored Pre-proline 0 C--N 1.318 -0.78 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.056 -171.22 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -49.9 -32.74 31.14 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 124.055 3.17 . . . . 0.0 113.869 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -71.25 -43.05 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.724 0.297 . . . . 0.0 110.896 -179.407 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' GLU . . . . . 0.465 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 8.0 mt-10 -67.27 -36.97 82.67 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.7 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.435 HD11 ' HB3' ' B' ' 46' ' ' ARG . 0.5 OUTLIER -61.8 -34.58 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.796 177.319 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -72.79 -41.43 64.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.928 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.02 -48.47 16.09 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -173.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -99.48 -35.63 9.82 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.628 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.62 -175.93 16.11 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.616 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.61 160.27 64.11 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . 0.43 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 25.5 Cg_exo -63.0 124.86 14.72 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.223 1.949 . . . . 0.0 112.913 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . 0.81 ' HB3' ' HB2' ' B' ' 126' ' ' PRO . 25.6 t70 -90.35 88.06 7.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.013 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.558 HG23 ' HB2' ' B' ' 62' ' ' TYR . 3.6 m -134.98 167.51 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . 0.859 ' HD2' ' HA ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -76.04 -27.84 57.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.929 0.395 . . . . 0.0 111.17 -176.88 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -122.65 68.77 0.97 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.458 -175.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' TYR . . . . . 0.806 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.3 t80 -121.79 127.49 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.816 0.341 . . . . 0.0 110.345 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.694 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 61.8 mttm -122.83 122.33 38.41 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 177.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -88.87 133.18 34.37 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 -177.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' MET . . . . . 0.505 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.474 0 CA-C-O 121.085 0.469 . . . . 0.0 110.796 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.72 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.72 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -54.38 -46.56 98.99 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -174.659 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . 0.53 ' HD3' ' OE1' ' B' ' 71' ' ' GLU . 58.3 Cg_endo -71.18 -20.14 28.72 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.333 1.355 . . . . 0.0 111.921 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.505 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -86.33 -26.47 24.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.189 0.518 . . . . 0.0 110.015 177.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.596 HD23 HD22 ' B' ' 102' ' ' LEU . 4.6 tp -58.0 -52.75 64.21 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.958 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.69 -28.49 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.636 -175.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -91.75 -13.48 31.51 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.361 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' SER . . . . . 0.694 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 20.3 m -72.86 -27.67 62.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.897 0.38 . . . . 0.0 110.5 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . 0.406 ' O ' ' HE3' ' B' ' 63' ' ' LYS . . . 90.77 64.02 1.21 Allowed Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.433 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.404 HD11 ' HG ' ' B' ' 74' ' ' LEU . 5.2 mt -113.31 140.69 47.79 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.649 0.262 . . . . 0.0 110.406 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.867 ' HB3' ' HE3' ' B' ' 83' ' ' LYS . 3.3 t70 -114.55 133.03 22.58 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' PRO . . . . . 0.609 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 10.0 Cg_endo -57.6 -10.03 6.37 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.599 2.866 . . . . 0.0 115.266 -171.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.54 -10.53 34.52 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.679 -0.638 . . . . 0.0 110.924 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' LYS . . . . . 0.867 ' HE3' ' HB3' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -78.7 121.2 83.26 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.534 -177.407 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.765 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 4.8 Cg_exo -72.87 117.47 5.14 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.436 2.091 . . . . 0.0 109.984 173.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 12.3 m -121.1 158.24 23.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-O 121.313 0.578 . . . . 0.0 111.457 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.97 140.6 44.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . 0.698 ' HB ' ' HB3' ' B' ' 95' ' ' ALA . 1.8 m -110.84 122.48 65.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.122 0.487 . . . . 0.0 110.13 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' PHE . . . . . 0.771 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -81.34 161.39 23.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.376 -175.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 171.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . 0.698 ' HB3' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.53 0.173 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.03 -29.36 63.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.787 -176.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -76.98 -31.33 56.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.819 0.343 . . . . 0.0 110.879 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 98' ' ' ALA . . . . . 0.442 ' HB3' HD11 ' B' ' 70' ' ' LEU . . . -74.88 -35.1 62.31 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.025 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 99' ' ' GLY . . . . . 0.595 ' HA3' ' HE2' ' B' ' 22' ' ' MET . . . -94.7 -54.92 1.47 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.443 -0.884 . . . . 0.0 114.273 -174.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -28.44 67.87 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 122.399 -0.471 . . . . 0.0 111.981 -171.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.53 -35.83 70.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.892 0.377 . . . . 0.0 111.109 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 102' ' ' LEU . . . . . 0.596 HD22 HD23 ' B' ' 74' ' ' LEU . 15.4 mt -63.81 -46.61 84.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.751 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 103' ' ' ARG . . . . . 0.532 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.0 OUTLIER -66.02 -26.86 67.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.833 0.349 . . . . 0.0 110.725 -179.215 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.02 -6.16 36.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.219 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -110.56 -9.2 14.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.221 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 130.28 5.18 4.28 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.918 -1.134 . . . . 0.0 113.58 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 107' ' ' PHE . . . . . 0.609 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 5.9 m-85 -66.05 135.35 54.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.177 0.489 . . . . 0.0 110.276 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 6.3 mttt -61.24 -84.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.563 -174.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.35 119.13 35.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.095 0.474 . . . . 0.0 110.837 -178.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 110' ' ' ILE . . . . . 0.559 ' O ' HG21 ' B' ' 110' ' ' ILE . 0.4 OUTLIER -117.34 128.38 74.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-O 121.177 0.513 . . . . 0.0 110.588 -178.192 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -115.41 146.56 41.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.121 -175.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.615 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 4.5 t-20 -114.47 141.9 47.09 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 14.6 m -86.9 105.58 17.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.25 0.548 . . . . 0.0 111.611 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 21.75 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.929 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -116.44 -66.44 0.38 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.182 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 123.53 170.48 13.4 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.444 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 117' ' ' MET . . . . . 0.716 ' HE1' ' HG2' ' B' ' 46' ' ' ARG . 1.0 OUTLIER -63.16 -34.71 78.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.021 0.439 . . . . 0.0 110.484 -179.549 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.408 ' CG ' ' HZ1' ' B' ' 119' ' ' LYS . 2.7 p-10 -62.1 -31.13 71.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.053 178.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 119' ' ' LYS . . . . . 0.521 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -72.81 -32.12 65.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.963 179.392 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 120' ' ' TRP . . . . . 0.771 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.7 t-105 -60.21 -53.86 52.7 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 177.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . 0.42 HD21 ' HA ' ' B' ' 121' ' ' LEU . 6.5 mt -63.93 -40.92 97.58 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -63.57 -43.85 95.82 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.885 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -72.0 1.38 7.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.672 -176.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.12 27.47 66.25 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.932 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 85.5 mt -82.66 150.99 64.0 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . 0.81 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 13.5 Cg_endo -57.68 128.39 29.02 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 123.084 2.522 . . . . 0.0 112.547 -176.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.81 142.97 46.23 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.294 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.636 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.437 ' HE3' ' HD2' ' B' ' 81' ' ' PRO . 2.1 mpp? . . . . . 0 N--CA 1.461 0.084 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.728 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -53.52 -32.76 46.41 Favored Glycine 0 C--O 1.226 -0.402 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.876 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.88 -32.55 74.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.994 0.425 . . . . 0.0 111.418 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.4 mmtm -69.79 -57.73 4.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.924 -175.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.728 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 4.9 p90 -77.79 -28.38 50.46 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.311 -0.556 . . . . 0.0 112.165 -174.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -45.0 71.11 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.006 0.431 . . . . 0.0 110.563 -177.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.63 -41.85 95.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.226 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -44.5 75.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.015 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -53.98 -46.84 71.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.264 0.554 . . . . 0.0 110.358 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.95 -26.53 65.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.466 178.235 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.86 -41.45 74.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.981 0.419 . . . . 0.0 110.602 177.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -71.32 -49.78 39.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.445 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.408 HG12 ' HG2' ' B' ' 71' ' ' GLU . 1.1 t -65.63 -35.77 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.951 -174.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.2 mttt -63.57 -30.2 71.35 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.803 0.335 . . . . 0.0 111.184 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.82 -26.37 68.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.145 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.55 -32.94 64.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.97 -178.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -78.42 -23.43 46.69 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.382 0.611 . . . . 0.0 110.582 172.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.01 -18.17 38.01 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.38 -22.26 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.889 -175.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.649 ' HE3' HG23 ' A' ' 87' ' ' VAL . 4.3 ptm -127.43 179.55 5.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.668 0.271 . . . . 0.0 111.018 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.5 t -80.14 108.24 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.471 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.13 121.6 25.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.944 0.402 . . . . 0.0 110.644 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 113' ' ' SER . 3.6 mt -134.73 143.61 47.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.065 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.98 141.88 75.48 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.888 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.595 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 5.8 Cg_endo -49.83 -22.92 7.84 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.825 3.017 . . . . 0.0 114.331 -175.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -45.83 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.076 -0.39 . . . . 0.0 110.642 174.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -68.32 -29.49 68.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.195 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.61 -46.06 49.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.779 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.589 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 66.5 t80 -66.26 -28.53 68.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 0.0 110.768 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -53.58 56.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -73.43 -27.39 61.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.711 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.643 HD12 ' HB2' ' A' ' 42' ' ' LEU . 1.1 mt -60.71 -55.25 35.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -74.0 -26.75 60.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.028 -176.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -79.08 -40.11 32.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.934 0.397 . . . . 0.0 110.584 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.4 ' C ' ' H ' ' A' ' 39' ' ' ASP . 15.2 m-80 -118.78 100.51 50.97 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.669 -176.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -68.13 5.08 1.25 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.977 2.451 . . . . 0.0 112.394 178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.4 ' H ' ' C ' ' A' ' 37' ' ' ASN . 0.6 OUTLIER -84.73 -33.12 23.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.552 174.475 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.662 HG12 ' HB2' ' A' ' 84' ' ' PRO . 13.9 mt -86.63 106.93 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.389 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.45 HG21 ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -95.65 146.41 24.51 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.686 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.643 ' HB2' HD12 ' A' ' 34' ' ' LEU . 7.9 tp -98.45 127.62 44.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 83.1 mt -111.86 121.85 65.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -109.3 148.14 31.52 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.226 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.39 98.82 5.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.542 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.5 mmm-85 -156.28 -170.81 3.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.669 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -100.02 129.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.843 0.354 . . . . 0.0 110.268 176.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.05 -19.34 65.91 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.684 2.256 . . . . 0.0 113.086 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -72.01 -51.26 22.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.779 0.324 . . . . 0.0 111.061 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.475 ' HB3' ' CB ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -73.16 -27.6 61.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.338 177.137 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.602 HD23 ' CE1' ' A' ' 64' ' ' HIS . 0.7 OUTLIER -58.98 -46.69 87.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.111 174.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -30.89 71.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.72 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.29 -48.3 11.38 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 36.6 mtm -92.24 -34.45 14.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -171.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 139.19 146.12 4.87 Favored Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.541 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.44 ' HE3' HD11 ' A' ' 128' ' ' LEU . 0.0 OUTLIER -133.44 141.52 40.7 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 177.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.429 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 9.4 Cg_endo -56.98 121.9 10.88 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.547 2.165 . . . . 0.0 112.438 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -93.22 93.38 8.21 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.546 ' CG2' ' HB2' ' A' ' 62' ' ' TYR . 15.9 m -132.07 162.48 39.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.31 83.44 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.45 ' HB2' HG21 ' A' ' 41' ' ' THR . 19.4 p-10 -128.75 79.9 1.94 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.571 0.7 . . . . 0.0 111.286 -174.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.546 ' HB2' ' CG2' ' A' ' 59' ' ' VAL . 9.3 t80 -122.3 129.86 52.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.279 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 0.0 OUTLIER -125.07 122.39 37.06 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.183 0.516 . . . . 0.0 110.934 178.911 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.602 ' CE1' HD23 ' A' ' 51' ' ' LEU . 2.7 t-160 -92.0 116.95 29.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.426 177.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.901 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.611 0 CA-C-O 120.655 0.264 . . . . 0.0 110.791 -176.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.901 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.674 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.596 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -44.67 -58.5 5.22 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -173.443 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.596 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 13.3 Cg_exo -73.16 -16.95 25.01 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 122.079 1.853 . . . . 0.0 113.209 -175.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.707 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -96.46 -15.33 21.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.651 0.262 . . . . 0.0 110.685 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.484 HD22 ' CD1' ' B' ' 7' ' ' PHE . 30.6 tp -58.16 -54.95 41.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.168 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.76 -16.41 61.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.838 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -88.58 -17.9 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.575 ' HB3' ' HE3' ' A' ' 65' ' ' MET . 0.2 OUTLIER -100.84 43.85 1.04 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.766 -175.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 43.47 64.7 1.73 Allowed Glycine 0 C--N 1.335 0.477 0 O-C-N 123.616 0.573 . . . . 0.0 113.459 175.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.434 HD11 HD13 ' A' ' 74' ' ' LEU . 8.0 mt -116.32 128.64 55.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.131 0.491 . . . . 0.0 111.033 -177.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' A' ' 82' ' ' GLU . 0.6 OUTLIER -129.82 149.93 74.44 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.809 178.373 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.36 17.75 0.28 Allowed 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.889 2.393 . . . . 0.0 113.59 -174.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.403 ' H ' ' C ' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -120.21 6.17 10.75 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.083 0.468 . . . . 0.0 110.179 176.554 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.1 mttm -106.88 133.8 20.12 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.662 ' HB2' HG12 ' A' ' 40' ' ' ILE . 2.5 Cg_endo -77.74 141.54 19.51 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.732 2.288 . . . . 0.0 110.721 175.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.731 HG22 HD13 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -143.93 148.32 18.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.834 0.349 . . . . 0.0 110.624 -177.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.449 HG11 HD11 ' A' ' 42' ' ' LEU . 1.4 p -123.86 140.05 48.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.649 HG23 ' HE3' ' A' ' 22' ' ' MET . 13.3 m -108.57 134.72 49.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.345 -176.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.835 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.4 t80 -101.06 162.68 12.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.225 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' CYS . . . . . 0.507 ' HA ' ' HA2' ' A' ' 116' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 174.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.555 ' CB ' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.46 0.051 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.84 -31.91 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.697 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.64 -33.69 76.21 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.616 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.18 -49.73 18.54 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.039 0.447 . . . . 0.0 110.913 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.501 ' HA2' HD12 ' A' ' 110' ' ' ILE . . . -75.79 -51.69 6.93 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.46 -0.791 . . . . 0.0 114.127 -173.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.472 ' HZ3' ' CD ' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -65.33 -30.57 71.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.914 0.387 . . . . 0.0 111.056 -174.282 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 32.7 m -72.16 -36.75 69.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.912 176.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.05 -42.91 79.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.517 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.711 ' HB3' HG23 ' A' ' 110' ' ' ILE . 4.0 ptm180 -67.7 -27.24 66.66 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.849 0.357 . . . . 0.0 110.361 179.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.472 ' CD ' ' HZ3' ' A' ' 100' ' ' LYS . 0.5 OUTLIER -69.75 -6.91 35.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.361 174.644 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.517 ' CE1' ' HB ' ' B' ' 10' ' ' THR . 22.5 m-85 -107.4 -12.11 15.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.683 0.278 . . . . 0.0 110.762 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.46 50.98 0.73 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.323 173.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -88.43 -179.84 6.17 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.679 -0.307 . . . . 0.0 110.584 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.454 ' HB3' ' H ' ' A' ' 109' ' ' THR . 5.4 mttt -85.46 -97.02 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.655 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.454 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -112.19 115.91 29.59 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.742 0.305 . . . . 0.0 110.554 179.041 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.731 HD13 HG22 ' A' ' 85' ' ' VAL . 1.5 tt -118.05 127.72 75.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.068 0.461 . . . . 0.0 110.743 -176.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -115.62 144.95 43.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.625 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.566 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 4.1 t-20 -107.87 136.14 48.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 171.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.462 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.1 m -88.45 108.76 19.55 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.704 0.287 . . . . 0.0 111.759 -175.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -58.89 135.59 57.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.296 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 93.1 -106.88 3.47 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.75 -174.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . 0.538 ' H ' ' HB2' ' A' ' 119' ' ' LYS . . . 160.79 -156.97 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' MET . . . . . 0.468 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 2.2 ttm -59.02 -33.68 71.02 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.203 0.525 . . . . 0.0 109.987 177.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.8 OUTLIER -61.73 -32.28 72.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.014 177.205 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.595 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -74.6 -32.75 62.46 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 122.168 0.187 . . . . 0.0 111.476 178.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.835 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 24.8 t-105 -59.83 -53.32 59.35 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.5 mt -64.84 -38.94 92.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.967 177.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.7 OUTLIER -65.51 -35.77 81.85 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.873 0.368 . . . . 0.0 111.483 -178.294 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.711 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.0 tp10 -79.43 -3.89 48.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.3 29.18 68.74 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 121.056 -0.593 . . . . 0.0 112.041 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.711 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 52.3 mt -80.94 160.65 65.69 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-O 120.679 0.276 . . . . 0.0 110.879 -176.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 21.0 Cg_endo -58.47 117.58 4.32 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.079 2.519 . . . . 0.0 112.47 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.4 m -128.44 146.39 50.82 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.44 HD11 ' HE3' ' A' ' 56' ' ' LYS . 3.2 mt -99.36 103.1 14.88 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.077 0.465 . . . . 0.0 110.105 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.676 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' MET . . . . . 0.542 ' HG3' ' HG3' ' B' ' 6' ' ' LYS . 1.9 mpp? . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.738 0.304 . . . . 0.0 111.279 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' GLY . . . . . 0.705 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.31 -39.24 81.9 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.633 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -63.48 -33.04 74.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.299 -0.451 . . . . 0.0 111.421 176.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.542 ' HG3' ' HG3' ' B' ' 3' ' ' MET . 1.7 mmmt -71.27 -52.24 20.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.626 -175.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . 0.705 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 2.2 p90 -82.41 -24.31 34.44 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.267 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.92 -49.49 65.87 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.777 0.322 . . . . 0.0 110.683 -179.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.67 -44.71 77.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.255 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' THR . . . . . 0.517 ' HB ' ' CE1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -64.89 -42.86 94.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.938 179.132 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' PHE . . . . . 0.448 ' O ' ' HB ' ' B' ' 15' ' ' VAL . 0.5 OUTLIER -57.85 -47.96 81.17 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.013 0.435 . . . . 0.0 110.428 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' LYS . . . . . 0.605 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.41 -25.9 68.22 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.185 177.597 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.21 -47.53 27.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.101 0.477 . . . . 0.0 111.262 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.89 -50.37 35.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.688 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.485 HG13 ' HG2' ' A' ' 71' ' ' GLU . 0.5 OUTLIER -60.2 -33.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.633 -176.791 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . 0.605 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.1 OUTLIER -70.8 -38.9 73.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.594 0.235 . . . . 0.0 110.978 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . 0.478 ' HA ' ' HB1' ' B' ' 20' ' ' ALA . . . -59.08 -25.82 64.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.493 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.34 81.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.683 -179.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' B' ' 16' ' ' LYS . 4.9 pttp -77.62 -22.0 51.44 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.293 0.568 . . . . 0.0 110.865 174.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . 0.478 ' HB1' ' HA ' ' B' ' 17' ' ' ALA . . . -78.79 -19.48 52.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.54 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . 0.411 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 25.4 t70 -69.18 -25.84 64.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.751 -175.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' MET . . . . . 0.663 ' HE3' HG23 ' B' ' 87' ' ' VAL . 12.4 ptm -117.49 179.87 3.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.814 0.34 . . . . 0.0 111.708 -177.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 34.8 t -76.61 113.64 15.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.527 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.04 112.67 21.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.896 -177.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . 0.489 HD22 ' HA ' ' B' ' 25' ' ' LEU . 4.1 mt -112.39 -169.09 1.41 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.02 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.69 144.65 47.11 Favored Pre-proline 0 C--N 1.317 -0.848 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 173.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.0 -25.14 11.92 Favored 'Trans proline' 0 CA--C 1.531 0.335 0 C-N-CA 123.554 2.836 . . . . 0.0 113.581 -176.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -43.22 59.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.969 0.414 . . . . 0.0 110.72 176.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.89 -32.97 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.95 178.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . 0.429 ' HB3' HG23 ' B' ' 86' ' ' VAL . . . -66.69 -47.33 72.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.734 178.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' TYR . . . . . 0.616 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 71.5 t80 -67.92 -30.53 69.87 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.811 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -55.73 -53.1 60.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.946 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.563 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.2 OUTLIER -74.36 -27.05 60.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.813 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.681 HD12 ' HB2' ' B' ' 42' ' ' LEU . 2.9 mt -60.46 -55.9 27.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.024 0.44 . . . . 0.0 111.797 -178.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -76.03 -19.12 58.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.103 -0.499 . . . . 0.0 112.02 -173.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -16.72 18.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.486 -178.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.563 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 10.6 m-80 -121.32 101.24 44.22 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -66.2 -5.51 12.61 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 123.161 2.574 . . . . 0.0 113.416 -176.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.408 ' CG ' ' HZ3' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -98.28 -19.67 17.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.745 0.307 . . . . 0.0 110.84 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.62 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 26.5 mt -82.68 105.24 12.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.926 176.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.561 HG21 ' HB2' ' B' ' 61' ' ' ASN . 0.2 OUTLIER -98.72 145.18 27.17 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.05 -176.615 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.681 ' HB2' HD12 ' B' ' 34' ' ' LEU . 12.7 tp -100.91 125.18 47.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.755 HG12 ' HE2' ' B' ' 65' ' ' MET . 2.0 mt -105.55 115.57 47.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 175.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.75 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -101.26 133.66 45.5 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -126.78 98.96 5.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.599 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . 0.428 ' HG3' ' N ' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -160.16 154.93 24.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.314 -174.252 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.428 ' N ' ' HG3' ' B' ' 46' ' ' ARG . 0.0 OUTLIER -59.74 144.89 84.75 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 120.986 0.422 . . . . 0.0 111.241 -178.835 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.06 -18.54 35.55 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 123.322 2.681 . . . . 0.0 114.01 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.475 ' CB ' ' HB3' ' A' ' 50' ' ' GLU . 1.0 OUTLIER -74.89 -42.65 57.42 Favored 'General case' 0 CA--C 1.51 -0.568 0 O-C-N 121.867 -0.521 . . . . 0.0 111.296 -178.052 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -66.53 -35.09 79.39 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.777 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.4 mp -56.68 -34.17 67.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.417 176.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -79.31 -41.13 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.032 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.24 -48.06 13.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.476 -172.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -97.7 -34.32 10.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.755 0.312 . . . . 0.0 110.795 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 176.42 14.94 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.009 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' LYS . . . . . 0.777 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.1 OUTLIER -134.67 151.33 75.68 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.054 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -57.18 125.96 20.6 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.762 2.308 . . . . 0.0 112.671 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . 0.797 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 7.4 t0 -100.37 91.47 4.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.335 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 m -128.49 166.39 25.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 176.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -29.14 67.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.824 0.345 . . . . 0.0 111.239 -176.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.561 ' HB2' HG21 ' B' ' 41' ' ' THR . 5.1 p30 -131.22 77.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.261 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' TYR . . . . . 0.75 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.6 OUTLIER -130.42 141.01 50.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.961 178.165 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.636 ' HE3' HD22 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -135.31 135.41 40.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.86 0.362 . . . . 0.0 110.675 175.65 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -88.69 118.64 28.51 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' MET . . . . . 0.755 ' HE2' HG12 ' B' ' 43' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.676 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.557 HD13 HD11 ' B' ' 74' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.112 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.682 ' HB2' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -45.94 -66.1 0.56 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -174.46 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . 0.682 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 55.3 Cg_endo -74.43 -15.13 22.42 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 121.99 1.794 . . . . 0.0 113.79 -177.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.489 HD21 ' HA ' ' B' ' 73' ' ' LEU . 0.1 OUTLIER -83.04 -15.11 52.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.218 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.557 HD11 HD13 ' B' ' 70' ' ' LEU . 9.0 tp -58.51 -53.84 53.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.975 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.09 -24.94 65.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.73 -25.98 49.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.745 -175.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' SER . . . . . 0.526 ' HB2' ' HE3' ' B' ' 65' ' ' MET . 1.4 m -106.31 43.99 1.09 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -173.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.75 77.77 0.09 OUTLIER Glycine 0 C--N 1.336 0.566 0 N-CA-C 114.495 0.558 . . . . 0.0 114.495 172.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.636 HD22 ' HE3' ' B' ' 63' ' ' LYS . 53.3 mt -127.59 136.19 51.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.711 0.255 . . . . 0.0 110.697 177.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.458 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 3.5 t0 -135.47 136.63 24.43 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.624 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' PRO . . . . . 0.581 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 32.9 Cg_exo -63.35 11.82 0.09 OUTLIER 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 123.542 2.828 . . . . 0.0 114.828 -173.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.95 -8.53 17.57 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 121.778 -0.576 . . . . 0.0 110.492 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' LYS . . . . . 0.436 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.8 mttp -90.93 134.18 30.75 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.751 -176.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.62 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 1.3 Cg_endo -78.6 121.82 5.28 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.756 2.304 . . . . 0.0 110.198 171.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.516 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.1 OUTLIER -127.23 151.68 34.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 120.959 0.409 . . . . 0.0 111.177 -174.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.501 HG11 HD11 ' B' ' 42' ' ' LEU . 1.4 p -125.18 140.19 48.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . 0.827 ' HB ' ' HB2' ' B' ' 95' ' ' ALA . 16.6 m -108.25 137.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.342 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' PHE . . . . . 0.775 ' HZ ' ' HB2' ' B' ' 120' ' ' TRP . 8.3 t80 -120.19 143.9 47.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.575 -175.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.438 0 O-C-N 123.824 0.703 . . . . 0.0 111.31 -177.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . 0.827 ' HB2' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.529 0.165 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.05 -32.19 69.54 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.101 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -73.44 -26.94 61.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.858 0.361 . . . . 0.0 110.633 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 98' ' ' ALA . . . . . 0.509 ' HB3' HD23 ' B' ' 70' ' ' LEU . . . -73.65 -44.63 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.007 0.432 . . . . 0.0 110.691 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 99' ' ' GLY . . . . . 0.632 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -85.32 -45.46 5.86 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.637 -0.792 . . . . 0.0 114.061 -173.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 100' ' ' LYS . . . . . 0.476 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -64.71 -34.77 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.99 0.424 . . . . 0.0 111.19 -174.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 101' ' ' THR . . . . . 0.476 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 3.9 m -72.56 -35.43 67.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.179 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 102' ' ' LEU . . . . . 0.486 HD21 ' CE1' ' B' ' 107' ' ' PHE . 8.1 mt -67.04 -42.98 83.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -177.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 103' ' ' ARG . . . . . 0.743 ' HB3' HG23 ' B' ' 110' ' ' ILE . 0.0 OUTLIER -65.45 -26.59 68.02 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.08 0.467 . . . . 0.0 110.211 178.5 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.02 -7.38 48.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.701 177.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -108.21 -17.55 13.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.634 0.254 . . . . 0.0 110.876 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.73 29.05 1.46 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 119.987 -1.101 . . . . 0.0 113.351 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 107' ' ' PHE . . . . . 0.486 ' CE1' HD21 ' B' ' 102' ' ' LEU . 2.7 m-85 -74.36 154.97 38.62 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 108' ' ' LYS . . . . . 0.519 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -66.75 -92.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.065 0.459 . . . . 0.0 111.278 -174.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.519 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.2 OUTLIER -115.28 110.89 20.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.27 -178.935 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 110' ' ' ILE . . . . . 0.743 HG23 ' HB3' ' B' ' 103' ' ' ARG . 1.3 tt -112.23 128.58 68.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.035 0.445 . . . . 0.0 110.49 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -117.77 148.13 42.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.734 -174.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.4 ' HA ' HG21 ' B' ' 87' ' ' VAL . 11.8 t-20 -116.77 141.58 48.02 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 16.1 m -91.1 107.44 19.2 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -175.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.48 158.13 34.45 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.021 0.438 . . . . 0.0 110.748 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 90.74 -78.71 1.43 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.76 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 142.27 -170.12 25.14 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.164 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 117' ' ' MET . . . . . 0.588 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 4.0 tpp -66.11 -30.28 70.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 110.32 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.562 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.28 -32.28 71.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.971 179.549 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 119' ' ' LYS . . . . . 0.427 ' HZ1' ' CG ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -69.64 -32.61 71.39 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 120' ' ' TRP . . . . . 0.775 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 18.2 t-105 -60.23 -54.86 40.71 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . 0.478 HD21 ' HA ' ' B' ' 121' ' ' LEU . 7.1 mt -66.95 -39.39 87.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.127 179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.562 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.9 OUTLIER -63.69 -43.41 96.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.799 -176.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . 0.459 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 3.1 tp10 -75.7 -2.95 31.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.25 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.35 30.4 60.6 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.799 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.459 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 52.2 mt -76.64 157.7 81.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . 0.51 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 25.2 Cg_endo -61.52 120.54 8.24 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.849 2.366 . . . . 0.0 112.25 -177.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.22 144.54 38.52 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 128' ' ' LEU . . . . . 0.797 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 19.8 mt . . . . . 0 C--N 1.321 -0.665 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 120.858 0.361 . . . . 0.0 111.668 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.783 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -50.45 -24.97 7.94 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.513 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.7 -31.91 68.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.901 0.381 . . . . 0.0 111.218 177.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -64.98 -57.24 9.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.098 -175.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.783 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.2 p90 -76.28 -21.23 56.53 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.391 -176.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.44 -49.81 63.85 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.348 0.405 . . . . 0.0 110.301 -178.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.81 85.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.458 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.5 -45.3 80.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.267 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CD2' HD23 ' B' ' 74' ' ' LEU . 0.9 OUTLIER -58.97 -47.28 85.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.147 0.498 . . . . 0.0 110.277 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.505 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -64.91 -26.64 68.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.289 178.024 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -41.89 61.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.0 0.428 . . . . 0.0 111.618 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -71.09 -49.82 40.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.625 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.3 t -63.01 -34.86 68.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.379 -177.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -68.86 -35.21 76.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.646 0.26 . . . . 0.0 111.25 178.524 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.99 -26.06 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.643 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.0 -35.66 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.489 ' HA ' ' SD ' ' A' ' 22' ' ' MET . 0.8 OUTLIER -74.64 -19.23 60.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.658 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.24 -24.81 59.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.474 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -87.47 17.86 4.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.915 0.388 . . . . 0.0 111.943 -175.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.52 ' HB3' ' HE1' ' A' ' 22' ' ' MET . 0.0 OUTLIER -144.79 165.2 28.76 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.121 -0.362 . . . . 0.0 111.462 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.1 t -84.03 104.51 12.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.544 174.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.629 ' HB3' ' HG2' ' A' ' 114' ' ' GLU . 0.7 OUTLIER -82.6 114.05 20.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.212 0.529 . . . . 0.0 110.85 -175.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.429 ' O ' ' HA ' ' A' ' 113' ' ' SER . 3.3 mt -122.98 147.05 47.07 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.252 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.6 142.9 78.1 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.177 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.697 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 4.9 Cg_endo -47.59 -31.05 13.31 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.551 2.834 . . . . 0.0 113.553 -178.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -74.05 -41.5 61.66 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 122.188 -0.32 . . . . 0.0 110.763 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.48 -37.44 85.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.233 175.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.403 ' HB3' HG22 ' A' ' 86' ' ' VAL . . . -71.13 -46.85 60.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.945 -179.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.599 ' HA ' HD13 ' A' ' 34' ' ' LEU . 88.0 t80 -66.67 -31.46 72.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.945 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -53.0 63.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.001 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.508 ' HB2' HD11 ' A' ' 40' ' ' ILE . 0.3 OUTLIER -71.03 -26.31 63.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.896 177.701 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.599 HD13 ' HA ' ' A' ' 31' ' ' TYR . 7.1 mt -60.14 -55.36 34.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.24 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.463 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 0.2 OUTLIER -73.49 -32.11 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.282 -176.974 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -77.33 -28.59 53.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.95 0.405 . . . . 0.0 111.077 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -125.85 100.7 30.51 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.736 -177.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.19 0.65 3.07 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.028 2.485 . . . . 0.0 112.887 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.68 -24.77 20.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.249 0.547 . . . . 0.0 109.814 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.687 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 55.8 mt -89.11 107.24 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.26 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.488 HG21 ' O ' ' A' ' 61' ' ' ASN . 0.3 OUTLIER -95.11 145.37 25.04 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.513 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.592 ' HB2' HD12 ' A' ' 34' ' ' LEU . 5.8 tp -103.36 130.04 50.56 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.709 HD12 HD12 ' A' ' 79' ' ' LEU . 92.3 mt -113.83 120.47 63.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.676 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.793 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -102.16 132.35 48.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.84 99.5 8.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.136 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.625 ' HD2' ' OE2' ' A' ' 50' ' ' GLU . 3.9 mmt180 -156.51 -177.2 6.42 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.631 ' HB3' ' HD2' ' A' ' 48' ' ' PRO . 63.3 m-20 -111.35 168.98 6.8 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.631 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 55.9 Cg_endo -77.84 -23.44 9.44 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 121.863 1.709 . . . . 0.0 114.454 -168.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.69 -49.64 51.54 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.141 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.625 ' OE2' ' HD2' ' A' ' 46' ' ' ARG . 11.5 pm0 -70.25 -33.53 71.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.576 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.646 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.9 OUTLIER -62.73 -37.33 86.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.117 178.123 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -37.31 84.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.35 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.64 -50.56 10.47 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -172.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' MET . . . . . 0.455 ' HE2' ' HG2' ' A' ' 117' ' ' MET . 0.1 OUTLIER -100.3 -33.57 10.35 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.139 -174.004 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 176.47 14.56 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.799 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.646 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -143.89 158.42 56.05 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.4 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 15.6 Cg_endo -62.83 138.45 68.89 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 121.996 1.797 . . . . 0.0 112.589 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.4 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 3.6 t70 -112.41 94.05 4.74 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.686 177.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.461 HG13 ' CD1' ' A' ' 31' ' ' TYR . 2.0 m -131.95 162.61 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.303 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.463 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -55.17 -45.56 75.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.045 -176.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.488 ' O ' HG21 ' A' ' 41' ' ' THR . 14.0 p30 -122.56 73.48 1.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.76 0.79 . . . . 0.0 111.027 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.793 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.6 t80 -114.95 128.41 56.27 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.981 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -120.46 121.44 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.807 0.337 . . . . 0.0 110.444 177.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.413 ' O ' ' HE2' ' A' ' 65' ' ' MET . 10.6 t-160 -90.14 116.17 27.94 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 176.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.806 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.676 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.831 -175.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.77 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.844 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.716 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 0.4 OUTLIER -49.32 -64.84 1.0 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.041 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.716 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 11.4 Cg_exo -73.86 -17.26 22.83 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.205 1.937 . . . . 0.0 113.219 -176.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.806 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.6 OUTLIER -91.52 -29.01 17.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -173.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.874 HD13 HD11 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -62.42 -29.81 70.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.299 0.571 . . . . 0.0 111.411 -177.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.537 ' HB3' ' HB2' ' B' ' 8' ' ' ASP . . . -71.18 -32.75 69.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.697 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.82 -15.33 42.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -174.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -27.39 59.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 -176.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.1 61.07 0.86 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.601 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.874 HD11 HD13 ' A' ' 74' ' ' LEU . 11.1 mt -114.54 146.08 41.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.744 0.307 . . . . 0.0 110.688 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -136.71 150.23 69.43 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.419 176.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.65 17.01 0.47 Allowed 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 123.008 2.472 . . . . 0.0 113.667 -175.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.73 -1.28 19.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.155 0.503 . . . . 0.0 109.765 174.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 9.5 mmtm -100.06 128.73 30.03 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.047 -177.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.687 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 4.7 Cg_exo -74.83 122.17 7.11 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.565 2.177 . . . . 0.0 110.103 173.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.459 HG21 HD13 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -127.32 149.48 32.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 120.988 0.423 . . . . 0.0 111.132 -174.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.458 HG11 HD11 ' A' ' 42' ' ' LEU . 1.5 p -122.34 137.88 54.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.246 175.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.641 HG13 ' HB2' ' A' ' 98' ' ' ALA . 6.4 m -105.81 134.1 48.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.845 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 24.9 t80 -118.23 144.15 45.99 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.424 -173.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.472 0.642 0 C-N-CA 123.766 0.826 . . . . 0.0 110.747 -175.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.495 ' HB2' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.462 0.144 0 CA-C-O 121.173 0.511 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.26 -36.72 76.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.556 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -70.44 -30.05 66.79 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.363 176.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . 0.641 ' HB2' HG13 ' A' ' 87' ' ' VAL . . . -75.83 -41.45 52.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.739 -177.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.48 ' HA2' HD12 ' A' ' 110' ' ' ILE . . . -93.63 -44.17 3.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.665 -171.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.26 -23.72 67.12 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.642 -0.328 . . . . 0.0 111.516 -174.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -54.24 14.81 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.131 0.491 . . . . 0.0 111.252 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.403 ' HA ' ' CD2' ' A' ' 105' ' ' TYR . 57.0 mt -56.27 -38.17 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.198 -172.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.601 ' HB3' HG23 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.05 -31.21 70.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.121 -179.567 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.86 -8.65 58.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.851 0.357 . . . . 0.0 110.938 176.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.61 ' HH ' ' HG3' ' B' ' 14' ' ' GLN . 16.7 m-30 -92.77 -38.28 11.88 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.09 50.94 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.476 -0.868 . . . . 0.0 112.583 174.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -92.92 159.73 15.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.617 0.246 . . . . 0.0 110.623 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -69.02 0.39 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.466 -177.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.05 117.4 12.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.981 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.601 HG23 ' HB3' ' A' ' 103' ' ' ARG . 1.0 OUTLIER -119.16 128.84 75.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.217 0.532 . . . . 0.0 110.948 -179.578 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -119.27 152.28 36.96 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.544 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -121.98 148.48 44.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.438 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 5.8 m -89.11 113.47 24.63 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -174.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.629 ' HG2' ' HB3' ' A' ' 24' ' ' MET . 1.0 OUTLIER -64.45 143.45 57.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.623 177.646 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 96.0 -104.93 3.17 Favored Glycine 0 N--CA 1.443 -0.854 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 171.11 -165.07 38.19 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' MET . . . . . 0.569 ' HA ' ' CZ ' ' A' ' 88' ' ' PHE . 9.5 tpt -65.41 -29.48 70.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.036 178.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.582 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -61.71 -28.77 69.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.002 178.457 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.697 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -73.56 -33.01 64.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 111.447 0.165 . . . . 0.0 111.447 -178.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.845 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 18.8 t-105 -61.33 -54.54 42.59 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.828 0.347 . . . . 0.0 110.069 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.2 mt -62.89 -41.88 99.58 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.892 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.582 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.5 OUTLIER -65.33 -40.52 93.8 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.159 -177.007 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.584 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.7 tp10 -73.18 -4.89 35.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.918 0.39 . . . . 0.0 111.159 -177.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.49 27.33 63.63 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.771 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.584 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 97.1 mt -79.76 157.67 74.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 -178.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.406 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 20.6 Cg_endo -57.09 120.36 8.23 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 123.299 2.666 . . . . 0.0 112.209 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.47 151.77 50.6 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.483 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.4 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 0.8 OUTLIER -100.52 107.87 19.67 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 176.506 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.385 -175.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.23 0 CA-C-O 120.628 0.252 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' GLY . . . . . 0.751 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.67 -32.86 70.31 Favored Glycine 0 C--O 1.223 -0.541 0 CA-C-N 116.055 -0.52 . . . . 0.0 112.195 178.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.12 -31.61 62.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.059 0.457 . . . . 0.0 110.599 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -69.35 -57.19 5.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.076 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . 0.751 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 3.8 p90 -72.56 -26.64 61.81 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.039 -0.664 . . . . 0.0 111.089 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . 0.537 ' HB2' ' HB3' ' A' ' 75' ' ' ALA . 0.3 OUTLIER -53.59 -42.78 67.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.556 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.07 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.995 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.82 -45.06 83.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.706 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' PHE . . . . . 0.589 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 0.1 OUTLIER -55.9 -46.94 78.23 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.307 0.575 . . . . 0.0 110.345 177.168 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' LYS . . . . . 0.641 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.24 -27.5 69.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.397 178.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.03 58.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.177 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . 0.61 ' HG3' ' HH ' ' A' ' 105' ' ' TYR . 10.6 mm-40 -70.96 -50.61 32.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.465 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -33.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.949 -178.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . 0.641 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -59.9 -39.36 85.09 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.573 0.225 . . . . 0.0 111.551 178.412 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.78 -26.39 68.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.977 0.418 . . . . 0.0 111.205 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.54 65.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.492 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -24.94 42.41 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.164 0.507 . . . . 0.0 111.128 173.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.61 -15.75 41.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.166 -173.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.98 -23.27 62.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -171.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' MET . . . . . 0.538 ' HE3' ' HB3' ' B' ' 100' ' ' LYS . 1.5 ptp -139.7 172.87 12.16 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.811 -177.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 22.9 t -67.27 109.55 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.553 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' MET . . . . . 0.461 ' HE1' ' HB3' ' B' ' 112' ' ' ASN . 0.4 OUTLIER -83.43 121.16 26.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.251 178.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.5 mt -129.5 141.63 50.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.9 -177.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.52 145.7 82.65 Favored Pre-proline 0 C--N 1.315 -0.934 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.503 ' HB3' ' HE3' ' B' ' 120' ' ' TRP . 1.3 Cg_endo -45.22 -29.74 4.57 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.01 3.14 . . . . 0.0 114.415 -175.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -44.84 49.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 111.143 177.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -29.9 68.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.472 178.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.35 -42.31 59.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.651 177.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' TYR . . . . . 0.481 ' CZ ' ' HG3' ' B' ' 126' ' ' PRO . 38.8 t80 -64.25 -40.59 96.33 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.036 0.446 . . . . 0.0 110.806 178.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' B' ' 36' ' ' GLU . 0.1 OUTLIER -50.3 -53.76 26.26 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.262 -177.421 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.583 HD11 HG23 ' B' ' 40' ' ' ILE . 0.3 OUTLIER -74.94 -27.57 60.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.268 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.464 HD23 ' HB2' ' B' ' 42' ' ' LEU . 3.2 mt -63.85 -57.52 9.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.146 0.498 . . . . 0.0 112.027 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.28 -18.28 55.49 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.047 -172.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' B' ' 32' ' ' LYS . 0.4 OUTLIER -98.2 -9.09 26.21 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.588 -176.537 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -133.76 106.74 11.72 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.818 0.342 . . . . 0.0 110.298 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -65.5 -2.73 6.57 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.23 2.62 . . . . 0.0 113.696 -176.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.54 -25.91 18.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.431 . . . . 0.0 110.115 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.583 HG23 HD11 ' B' ' 33' ' ' LEU . 9.1 mt -82.62 108.09 15.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.412 178.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.425 ' HA ' ' HB2' ' B' ' 61' ' ' ASN . 0.2 OUTLIER -101.57 144.83 29.84 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.093 -177.681 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.554 HD12 ' HB2' ' B' ' 88' ' ' PHE . 0.9 OUTLIER -103.96 127.96 51.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.923 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 2.0 mp -108.82 119.58 58.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 175.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.857 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -110.08 136.12 49.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.701 -178.73 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.09 100.05 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.88 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -153.88 152.93 31.2 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.964 -174.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -69.68 135.13 88.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.771 0.319 . . . . 0.0 110.566 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.01 -19.22 68.6 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.084 2.523 . . . . 0.0 113.851 -175.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.32 -40.08 37.75 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.825 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -67.57 -35.21 78.58 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.834 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.7 OUTLIER -60.27 -34.76 74.17 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.66 174.296 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -71.97 -41.74 67.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.834 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.99 -47.77 14.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.151 -172.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 12.4 mtt -102.36 -34.31 9.23 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.607 -173.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.94 178.28 15.45 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.821 176.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' LYS . . . . . 0.834 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 6.6 pttt -135.18 155.3 79.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.86 127.44 25.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.892 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . 0.67 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 26.5 t0 -101.99 81.68 2.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.272 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.499 HG21 ' HB2' ' B' ' 62' ' ' TYR . 0.9 OUTLIER -120.13 157.48 22.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.194 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -51.96 63.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.643 -175.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.425 ' HB2' ' HA ' ' B' ' 41' ' ' THR . 0.2 OUTLIER -109.82 80.65 1.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 0.0 110.545 -179.241 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' TYR . . . . . 0.857 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.5 t80 -121.32 130.56 53.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.046 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.535 ' HD2' ' HB3' ' B' ' 77' ' ' SER . 3.9 mttm -129.59 121.86 27.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.364 177.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -84.92 111.18 19.44 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' MET . . . . . 0.605 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--N 1.324 -0.505 0 CA-C-O 120.729 0.299 . . . . 0.0 110.289 -177.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.526 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.591 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -44.82 -58.23 5.74 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -172.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . 0.591 ' HD3' ' CD ' ' B' ' 71' ' ' GLU . 6.8 Cg_exo -73.52 -16.13 24.38 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.507 2.138 . . . . 0.0 112.818 -179.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.605 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -87.87 -19.68 27.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.458 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.64 HD22 HD23 ' B' ' 102' ' ' LEU . 24.2 tp -60.6 -51.42 69.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.701 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.85 -24.0 67.57 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.0 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.76 -22.05 50.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -177.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' SER . . . . . 0.564 ' HB2' ' HG ' ' B' ' 79' ' ' LEU . 0.3 OUTLIER -75.17 -39.65 60.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.803 0.335 . . . . 0.0 110.556 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.71 39.32 6.26 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.925 -177.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.564 ' HG ' ' HB2' ' B' ' 77' ' ' SER . 7.3 mt -83.2 151.75 25.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.602 0.239 . . . . 0.0 110.558 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.6 OUTLIER -125.48 133.72 25.13 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 37.4 Cg_exo -64.84 4.38 0.67 Allowed 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 123.502 2.801 . . . . 0.0 113.822 -176.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.37 -2.02 24.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.836 0.35 . . . . 0.0 110.799 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -109.74 146.03 33.21 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.94 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.573 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 7.9 Cg_exo -75.08 143.57 28.96 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 111.832 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.475 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.4 OUTLIER -143.74 147.43 19.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.759 -178.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.471 HG21 ' N ' ' B' ' 87' ' ' VAL . 2.3 p -124.78 139.63 50.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . 0.471 ' N ' HG21 ' B' ' 86' ' ' VAL . 4.4 m -109.28 124.31 65.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.094 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' PHE . . . . . 0.825 ' HZ ' ' HB2' ' B' ' 120' ' ' TRP . 9.6 t80 -104.4 136.62 43.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.148 -171.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' B' ' 117' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.67 0 O-C-N 124.291 0.995 . . . . 0.0 111.661 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 120.765 0.317 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 96' ' ' ALA . . . . . 0.544 ' HA ' HD22 ' B' ' 112' ' ' ASN . . . -54.77 -29.5 54.21 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.276 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -70.28 -32.04 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.888 0.375 . . . . 0.0 111.054 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.03 -44.26 55.0 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.01 0.433 . . . . 0.0 110.838 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 99' ' ' GLY . . . . . 0.556 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -80.45 -48.3 6.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.629 -0.796 . . . . 0.0 113.444 -175.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 100' ' ' LYS . . . . . 0.538 ' HB3' ' HE3' ' B' ' 22' ' ' MET . 0.0 OUTLIER -59.62 -42.74 93.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.809 0.337 . . . . 0.0 111.56 -172.748 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 101' ' ' THR . . . . . 0.446 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 0.7 OUTLIER -69.71 -35.34 74.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.461 -178.094 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 102' ' ' LEU . . . . . 0.64 HD23 HD22 ' B' ' 74' ' ' LEU . 9.2 mt -62.56 -50.42 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.554 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 103' ' ' ARG . . . . . 0.604 ' HB3' HG23 ' B' ' 110' ' ' ILE . 0.9 OUTLIER -65.98 -30.69 71.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.887 0.375 . . . . 0.0 110.597 -179.891 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.429 ' N ' ' HG3' ' B' ' 103' ' ' ARG . 7.2 mt-10 -71.24 -7.07 44.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.335 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -108.46 -11.51 15.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.746 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 129.74 14.73 2.05 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.017 -1.087 . . . . 0.0 113.89 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 107' ' ' PHE . . . . . 0.557 ' CE1' HD21 ' B' ' 102' ' ' LEU . 4.9 m-85 -70.97 140.23 50.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.399 0.599 . . . . 0.0 110.595 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.43 -81.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.784 -172.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.504 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -111.47 103.04 11.36 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.817 -176.213 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 110' ' ' ILE . . . . . 0.604 HG23 ' HB3' ' B' ' 103' ' ' ARG . 1.3 tt -114.47 131.1 67.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.472 0.653 . . . . 0.0 110.889 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -120.28 151.5 39.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.295 -178.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.544 HD22 ' HA ' ' B' ' 96' ' ' ALA . 4.6 t-20 -123.1 148.86 45.2 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.594 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 4.8 m -83.54 138.4 33.42 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.443 -177.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -97.39 152.99 18.38 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.117 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.98 -87.93 1.32 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.793 -176.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 150.31 -166.81 30.13 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.033 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 117' ' ' MET . . . . . 0.494 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 7.7 tmm? -67.96 -33.01 73.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.991 0.424 . . . . 0.0 110.66 179.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.564 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -63.87 -29.63 70.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.634 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 119' ' ' LYS . . . . . 0.5 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -69.14 -33.56 73.63 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.868 -0.151 . . . . 0.0 111.368 177.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 120' ' ' TRP . . . . . 0.825 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 34.8 t-105 -60.86 -53.56 55.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 9.5 mt -64.94 -39.73 93.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 178.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.564 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.3 OUTLIER -63.94 -34.62 78.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.716 -176.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . 0.539 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.7 OUTLIER -82.49 -0.85 48.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.939 0.399 . . . . 0.0 111.095 -178.576 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.26 29.38 68.55 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.143 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.539 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 77.6 mt -79.68 160.77 68.8 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . 0.612 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 21.9 Cg_endo -57.42 121.9 10.84 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 123.042 2.495 . . . . 0.0 112.152 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.56 151.14 52.02 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.436 -178.158 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 128' ' ' LEU . . . . . 0.67 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.1 mt . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.417 ' HG3' ' HB2' ' A' ' 6' ' ' LYS . 2.8 tpp . . . . . 0 C--O 1.232 0.172 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.584 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -55.99 -32.03 59.14 Favored Glycine 0 C--O 1.229 -0.192 0 CA-C-N 116.205 -0.452 . . . . 0.0 112.943 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.19 -33.08 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.75 0.31 . . . . 0.0 111.095 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.417 ' HB2' ' HG3' ' A' ' 3' ' ' MET . 20.1 mmtt -68.9 -58.04 4.69 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -172.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.584 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.6 OUTLIER -72.29 -34.05 67.89 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.468 -173.496 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.72 -57.35 11.17 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 123.309 0.381 . . . . 0.0 110.931 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.66 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' THR . . . . . 0.522 HG23 ' CE1' ' B' ' 105' ' ' TYR . 1.3 m -67.15 -44.94 78.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.255 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.412 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.3 OUTLIER -54.16 -42.96 70.2 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.32 0.581 . . . . 0.0 109.908 178.485 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -65.94 -26.24 67.49 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.904 177.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.85 -45.66 49.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.852 0.358 . . . . 0.0 110.914 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -71.77 -50.47 29.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.96 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.548 HG12 ' HG2' ' B' ' 71' ' ' GLU . 0.8 OUTLIER -68.38 -34.19 64.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.464 -172.628 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.545 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -66.53 -27.74 68.0 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.222 -0.299 . . . . 0.0 111.157 -177.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.73 66.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.005 0.431 . . . . 0.0 111.187 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.24 70.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.023 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -23.94 49.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.313 0.578 . . . . 0.0 110.93 175.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.77 -20.68 27.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.977 -176.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -32.86 73.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.627 ' HE3' ' HA3' ' A' ' 99' ' ' GLY . 6.6 ptm -125.7 178.73 5.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.98 0.419 . . . . 0.0 111.924 -175.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.0 t -74.58 111.44 10.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.098 -178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.687 ' HE1' ' HB3' ' A' ' 112' ' ' ASN . 2.0 mmt -79.89 105.41 11.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.861 -178.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.419 ' HB2' ' HB3' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -113.11 139.63 48.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.096 0.474 . . . . 0.0 110.583 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.7 143.29 67.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.796 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -51.29 -24.33 15.4 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.632 2.888 . . . . 0.0 113.951 -176.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 mtmt -74.29 -43.87 55.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.071 0.462 . . . . 0.0 110.909 177.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.45 -29.13 62.35 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.566 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.61 -45.34 62.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.634 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.541 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 74.5 t80 -67.23 -32.02 72.78 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.997 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.8 tptt -56.29 -50.17 72.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.146 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 37' ' ' ASN . 0.3 OUTLIER -74.23 -27.53 60.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.678 177.648 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.688 HD12 ' HB2' ' A' ' 42' ' ' LEU . 2.5 mt -64.23 -48.27 76.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.027 0.441 . . . . 0.0 111.379 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -21.93 57.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.416 -175.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.98 -27.89 15.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 111.232 -177.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.499 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 5.9 m-80 -112.24 108.91 54.58 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.515 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -71.39 0.57 6.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 122.779 2.319 . . . . 0.0 112.037 177.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.72 -26.44 13.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.586 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.817 HG12 ' HG2' ' A' ' 84' ' ' PRO . 36.7 mt -80.66 113.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.73 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.79 144.06 31.98 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 -177.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.855 HD11 HG12 ' A' ' 86' ' ' VAL . 27.2 tp -96.56 121.41 38.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.441 HD12 HD12 ' A' ' 79' ' ' LEU . 88.2 mt -103.18 111.11 31.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.777 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -104.73 140.85 37.47 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.18 98.22 5.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.489 177.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.559 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -144.19 149.17 35.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.404 179.249 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.559 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 4.5 m-20 -67.67 141.17 94.88 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.039 -175.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -58.13 -25.75 72.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.546 2.831 . . . . 0.0 114.464 -169.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.21 -43.48 57.01 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.974 -0.69 . . . . 0.0 111.955 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -65.1 -35.37 80.9 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.857 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.655 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -57.38 -35.42 69.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.72 176.353 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.5 mtpt -79.61 -43.54 22.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.253 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -91.12 -48.07 7.17 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 mtm -95.56 -35.1 11.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.339 -174.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.69 171.03 12.9 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 113.641 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.655 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -142.49 162.35 45.12 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.471 ' HD3' ' HE1' ' A' ' 117' ' ' MET . 16.2 Cg_endo -62.83 132.44 37.3 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 121.934 1.756 . . . . 0.0 112.679 -176.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -107.37 77.41 1.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.068 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.47 HG23 ' HB2' ' A' ' 62' ' ' TYR . 3.0 m -119.3 166.78 13.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.6 -41.16 93.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.982 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 86.0 2.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.033 0.444 . . . . 0.0 111.036 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.777 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.0 OUTLIER -128.98 132.81 47.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.56 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.95 119.78 32.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.473 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -86.68 118.73 26.28 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 175.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.72 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.637 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.264 -174.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.72 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.894 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.627 ' HB2' ' HE2' ' B' ' 12' ' ' LYS . 0.2 OUTLIER -44.05 -61.82 1.82 Allowed Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -172.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.583 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 7.6 Cg_exo -73.86 -15.85 23.59 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.448 2.098 . . . . 0.0 113.146 -178.038 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.568 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.1 OUTLIER -90.01 -19.08 24.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.908 0.385 . . . . 0.0 110.874 -177.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.601 HD12 HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -73.14 -28.94 62.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.385 0.612 . . . . 0.0 110.43 -179.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.56 -28.28 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.958 173.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -18.06 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.943 -177.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -41.3 27.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.969 0.414 . . . . 0.0 110.281 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.85 55.34 1.15 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.395 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.441 HD12 HD12 ' A' ' 43' ' ' ILE . 10.9 mt -94.32 145.22 24.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.665 0.269 . . . . 0.0 110.493 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -127.1 158.1 70.08 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 45.5 Cg_endo -70.93 9.16 0.84 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.89 2.393 . . . . 0.0 114.158 -174.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -1.9 11.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.824 0.345 . . . . 0.0 110.585 179.062 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.3 mmtm -88.53 134.6 33.89 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.29 -176.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.817 ' HG2' HG12 ' A' ' 40' ' ' ILE . 27.9 Cg_endo -88.29 124.31 1.7 Allowed 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.05 2.5 . . . . 0.0 111.261 175.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.618 HG22 HD13 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -135.35 149.92 28.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 111.205 -176.079 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.855 HG12 HD11 ' A' ' 42' ' ' LEU . 1.5 p -124.29 141.2 45.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.754 ' HB ' ' HB3' ' A' ' 95' ' ' ALA . 8.0 m -106.91 133.53 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.742 ' HZ ' ' HB2' ' A' ' 120' ' ' TRP . 14.4 t80 -116.97 137.2 52.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.935 -171.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 117' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.672 0 O-C-N 124.407 1.067 . . . . 0.0 112.034 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.754 ' HB3' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 C--O 1.229 -0.022 0 CA-C-O 120.907 0.384 . . . . 0.0 111.242 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.456 ' HA ' ' ND2' ' A' ' 112' ' ' ASN . . . -58.64 -34.94 71.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.194 179.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -67.11 -30.41 70.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.866 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.52 -40.6 49.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.791 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.627 ' HA3' ' HE3' ' A' ' 22' ' ' MET . . . -96.86 -40.8 3.72 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.852 -171.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -25.02 67.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.847 0.356 . . . . 0.0 111.24 -174.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.59 -49.67 38.19 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.842 177.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.601 HD23 HD12 ' A' ' 74' ' ' LEU . 22.8 mt -57.79 -42.21 83.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.682 -174.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.459 ' HB3' HG23 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -68.68 -26.62 65.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.84 0.352 . . . . 0.0 110.742 178.314 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.71 -8.39 57.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.226 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.481 ' HH ' ' HA ' ' B' ' 11' ' ' PHE . 14.2 m-85 -105.26 -42.05 5.37 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 176.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 142.53 85.32 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.349 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -126.44 156.75 40.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.605 0.24 . . . . 0.0 110.601 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -71.29 0.24 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.354 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.45 111.94 9.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.05 -177.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.618 HD13 HG22 ' A' ' 85' ' ' VAL . 1.5 tt -122.92 128.94 75.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.304 0.573 . . . . 0.0 111.062 -178.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.419 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 0.9 OUTLIER -117.52 149.84 39.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.501 -177.206 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.687 ' HB3' ' HE1' ' A' ' 24' ' ' MET . 8.1 t-20 -118.63 144.77 45.93 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.45 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 92.0 p -81.56 135.57 35.58 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.137 0.494 . . . . 0.0 111.95 -171.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.49 136.74 33.3 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.617 169.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 87.07 -127.13 8.28 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.271 -172.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -178.75 -159.96 23.98 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' MET . . . . . 0.471 ' HE1' ' HD3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -58.78 -33.79 70.71 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.401 . . . . 0.0 110.712 178.663 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.25 -34.37 72.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.962 178.465 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.434 ' HD2' ' OD1' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -73.93 -32.14 63.38 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.488 0.185 . . . . 0.0 111.174 -179.385 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.742 ' HB2' ' HZ ' ' A' ' 88' ' ' PHE . 18.6 t-105 -62.39 -54.28 42.58 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 121' ' ' LEU . 2.2 mt -63.77 -42.4 97.78 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.7 0.286 . . . . 0.0 111.045 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 2.1 tt0 -62.1 -40.98 97.69 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.793 -177.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.532 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.8 OUTLIER -77.78 -0.72 28.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 69.12 29.67 72.14 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.925 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.532 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 75.2 mt -77.4 158.42 79.15 Favored Pre-proline 0 N--CA 1.45 -0.472 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.526 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 19.7 Cg_endo -55.31 114.41 1.86 Allowed 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 123.262 2.642 . . . . 0.0 112.129 -179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.78 152.9 51.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.073 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.0 mt -102.96 100.5 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.317 -0.815 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.775 -178.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' MET . . . . . 0.503 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mpp? . . . . . 0 N--CA 1.453 -0.292 0 CA-C-O 120.647 0.261 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' GLY . . . . . 0.581 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.85 -33.7 69.11 Favored Glycine 0 C--O 1.226 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.52 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -31.25 62.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.864 0.364 . . . . 0.0 111.143 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.428 ' HG3' ' HA ' ' B' ' 3' ' ' MET . 4.8 mmtt -72.29 -58.06 3.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.269 -172.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . 0.581 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.1 p90 -73.69 -27.09 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.26 -175.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -47.12 69.38 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.425 0.453 . . . . 0.0 110.425 -177.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.9 -43.55 86.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.322 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -42.97 77.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.75 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' PHE . . . . . 0.584 ' CZ ' HD22 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -55.33 -48.76 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.307 0.575 . . . . 0.0 110.398 178.101 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' LYS . . . . . 0.627 ' HE2' ' HB2' ' A' ' 71' ' ' GLU . 1.8 tppt? -65.8 -26.05 67.52 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.94 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.19 -41.63 63.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.143 0.497 . . . . 0.0 111.061 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.55 -49.14 43.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.272 177.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . 0.465 HG12 ' HG2' ' A' ' 71' ' ' GLU . 1.2 t -64.45 -34.35 68.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.03 -174.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . 0.569 ' HD2' ' HG3' ' B' ' 12' ' ' LYS . 0.2 OUTLIER -68.35 -38.9 81.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.692 0.282 . . . . 0.0 111.187 -178.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.27 -32.32 68.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.806 -177.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.81 73.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.141 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.43 -23.77 42.94 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.456 0.646 . . . . 0.0 110.803 173.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.67 -14.01 46.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.957 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -73.99 -20.39 60.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.115 -174.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' MET . . . . . 0.583 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 3.4 ptm -122.45 177.77 5.26 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.91 0.386 . . . . 0.0 111.503 -178.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.9 t -74.49 110.62 9.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.595 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.03 109.08 14.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.688 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' B' ' 25' ' ' LEU . 2.7 mt -112.16 -168.76 1.36 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.052 0.453 . . . . 0.0 110.513 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 1.1 p -129.82 144.61 53.7 Favored Pre-proline 0 C--N 1.321 -0.67 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -52.76 -17.18 6.82 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 123.34 2.693 . . . . 0.0 113.817 -176.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.431 ' HZ1' ' CD ' ' B' ' 123' ' ' GLU . 12.3 mtmm -73.05 -47.08 47.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.946 176.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.47 -33.22 42.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.725 178.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . 0.528 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -64.21 -47.02 81.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.579 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' TYR . . . . . 0.461 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 39.0 t80 -66.92 -30.95 71.23 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.714 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -47.15 87.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.666 0.27 . . . . 0.0 111.32 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.549 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.3 OUTLIER -70.03 -26.57 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.088 -0.245 . . . . 0.0 110.991 178.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.683 HD12 ' HB2' ' B' ' 42' ' ' LEU . 51.7 mt -72.43 -45.36 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 110.705 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -73.59 -24.12 60.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.094 -174.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -105.13 -9.59 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.549 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 42.7 m-20 -129.47 111.18 17.8 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.731 0.3 . . . . 0.0 110.525 178.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -71.9 -1.63 10.25 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.155 2.57 . . . . 0.0 112.801 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -105.78 -26.31 11.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.542 -177.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.492 HG23 ' CD1' ' B' ' 33' ' ' LEU . 36.1 mt -77.53 110.58 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 175.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.433 HG23 ' HG3' ' B' ' 63' ' ' LYS . 1.1 m -100.64 144.67 29.34 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.791 -173.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.683 ' HB2' HD12 ' B' ' 34' ' ' LEU . 3.1 tp -104.85 125.31 50.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.42 HG22 ' HB2' ' B' ' 65' ' ' MET . 1.3 mp -104.34 114.05 42.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 175.221 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.819 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -102.8 133.9 47.08 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.446 -178.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' B' ' 46' ' ' ARG . 0.1 OUTLIER -122.13 97.86 5.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.547 -178.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' B' ' 45' ' ' VAL . 0.0 OUTLIER -149.21 164.35 35.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.731 -178.54 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -71.55 137.01 83.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.668 0.271 . . . . 0.0 110.961 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.04 -26.68 58.02 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.688 2.258 . . . . 0.0 113.54 -177.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . 0.641 ' HA ' ' HD3' ' B' ' 52' ' ' LYS . 4.2 t0 -78.39 -33.25 48.94 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.233 176.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' GLU . . . . . 0.473 ' CD ' HH21 ' B' ' 46' ' ' ARG . 3.5 mt-10 -65.14 -34.76 79.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.073 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.854 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 mp -65.42 -35.12 79.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.432 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' LYS . . . . . 0.641 ' HD3' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -69.62 -39.97 76.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.436 178.324 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.11 -48.31 13.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 112.609 -173.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -97.52 -35.01 10.78 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.492 -172.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.12 172.72 14.93 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.91 -0.662 . . . . 0.0 111.794 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' LYS . . . . . 0.854 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 11.9 pttt -140.47 155.31 69.91 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . 0.406 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 11.8 Cg_endo -59.02 124.26 15.29 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.51 2.14 . . . . 0.0 112.684 -177.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . 0.709 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 33.8 t0 -97.25 73.76 2.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.344 0.592 . . . . 0.0 110.486 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.572 HG23 ' HB2' ' B' ' 62' ' ' TYR . 2.8 m -113.31 171.26 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -30.07 55.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.979 0.419 . . . . 0.0 111.364 -174.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -122.55 65.23 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.649 -177.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' TYR . . . . . 0.819 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 1.2 t80 -114.85 125.29 53.5 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.477 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.433 ' HG3' HG23 ' B' ' 41' ' ' THR . 2.1 mttt -123.55 119.59 30.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' HIS . . . . . 0.475 ' O ' ' HE1' ' B' ' 65' ' ' MET . 2.2 t-160 -80.93 115.48 20.42 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' MET . . . . . 0.744 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.579 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.693 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.625 ' HB2' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -45.39 -60.71 2.98 Favored Pre-proline 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.16 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 11.8 Cg_exo -73.24 -16.09 25.16 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.576 2.184 . . . . 0.0 113.225 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . 0.744 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -85.53 -15.79 41.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.142 -175.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.44 ' HA ' HD11 ' B' ' 74' ' ' LEU . 9.5 tp -58.56 -49.19 78.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.262 0.553 . . . . 0.0 110.807 -179.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.32 -26.57 66.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.333 -179.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -74.43 -29.59 61.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.009 -175.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.54 -34.51 67.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 111.096 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.91 50.47 2.86 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.59 -0.815 . . . . 0.0 111.284 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 20.0 mt -97.23 148.42 23.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.778 0.323 . . . . 0.0 110.614 -178.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.448 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.5 OUTLIER -136.38 137.54 24.57 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.538 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 30.1 Cg_exo -67.23 24.17 0.11 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.416 2.744 . . . . 0.0 114.222 -174.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . 0.439 ' H ' ' C ' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -108.6 4.01 23.52 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.33 0.586 . . . . 0.0 109.793 174.986 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.2 mttp -119.17 132.86 23.8 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.16 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.451 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 6.1 Cg_exo -69.62 143.01 50.15 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.453 2.102 . . . . 0.0 110.865 174.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.544 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 2.1 m -141.47 151.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -176.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.486 HG22 ' HB2' ' B' ' 111' ' ' TYR . 2.8 p -127.46 142.79 42.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 175.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . 0.789 ' HB ' ' HB3' ' B' ' 95' ' ' ALA . 18.6 m -104.93 157.9 5.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' PHE . . . . . 0.675 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 4.4 t80 -122.99 111.4 16.56 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 125.171 1.389 . . . . 0.0 112.781 176.252 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . 0.789 ' HB3' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 C--O 1.226 -0.163 0 CA-C-O 120.94 0.4 . . . . 0.0 110.807 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.16 67.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 178.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 97' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' B' ' 97' ' ' LEU . 2.1 mm? -76.27 -28.07 56.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.271 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 98' ' ' ALA . . . . . 0.455 ' HB3' HD23 ' B' ' 70' ' ' LEU . . . -72.44 -30.94 65.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.321 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 99' ' ' GLY . . . . . 0.588 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -103.76 -46.22 1.42 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.727 -174.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 100' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -62.46 -33.12 74.2 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.571 -0.37 . . . . 0.0 111.142 -174.832 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 101' ' ' THR . . . . . 0.416 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 1.2 m -73.46 -36.29 65.83 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.941 0.4 . . . . 0.0 111.061 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 102' ' ' LEU . . . . . 0.41 ' HA ' HD21 ' B' ' 102' ' ' LEU . 5.6 mt -67.78 -38.53 83.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.258 -176.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -26.13 67.25 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.917 0.389 . . . . 0.0 110.612 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.43 -5.58 50.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.273 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . 0.522 ' CE1' HG23 ' A' ' 10' ' ' THR . 22.0 m-30 -105.8 -8.14 17.93 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.078 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 123.73 5.05 7.81 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.012 -1.09 . . . . 0.0 113.734 171.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -69.4 130.54 42.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 117.034 0.417 . . . . 0.0 110.589 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -57.58 -80.76 0.02 OUTLIER 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.087 -172.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.06 115.7 26.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.968 -177.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 110' ' ' ILE . . . . . 0.588 HD12 ' HA2' ' B' ' 99' ' ' GLY . 1.4 tt -118.92 127.37 75.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.604 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 111' ' ' TYR . . . . . 0.486 ' HB2' HG22 ' B' ' 86' ' ' VAL . 4.7 m-85 -113.39 144.5 42.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.387 -175.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.583 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 17.9 t-20 -117.62 143.41 46.16 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.146 -0.686 . . . . 0.0 109.146 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.588 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -83.06 134.32 35.03 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.633 -175.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.69 153.91 20.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.826 -1.079 . . . . 0.0 108.373 164.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . 0.574 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 82.9 -108.44 2.98 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 -173.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.15 -156.14 27.35 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.75 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 1.6 ttt -61.43 -35.21 76.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.961 0.41 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.8 -38.57 75.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.639 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 119' ' ' LYS . . . . . 0.574 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -66.46 -33.21 75.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.805 -179.495 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 120' ' ' TRP . . . . . 0.675 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 30.7 t-105 -59.99 -53.62 55.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . 0.435 HD21 ' HA ' ' B' ' 121' ' ' LEU . 12.8 mt -64.31 -39.69 94.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.861 177.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -61.59 -40.64 95.5 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.957 0.408 . . . . 0.0 111.369 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . 0.431 ' CD ' ' HZ1' ' B' ' 28' ' ' LYS . 73.9 mm-40 -74.05 -12.49 60.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.802 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.2 56.98 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.572 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.473 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 83.7 mt -80.34 159.3 70.35 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.273 . . . . 0.0 110.607 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . 0.473 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 14.3 Cg_endo -54.57 119.36 6.29 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 123.09 2.526 . . . . 0.0 112.163 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.48 152.75 51.42 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.316 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 128' ' ' LEU . . . . . 0.709 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 3.2 mt . . . . . 0 C--N 1.32 -0.703 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.4 ' HG3' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 111.563 0.208 . . . . 0.0 111.563 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.599 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -63.61 -52.27 47.4 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.041 178.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -59.75 -32.46 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.528 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HG3' ' HG3' ' A' ' 3' ' ' MET . 13.1 mmtt -66.42 -57.51 7.24 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.055 -175.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.599 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.3 OUTLIER -84.28 -22.7 30.64 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -175.624 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.517 ' HB2' ' HB1' ' B' ' 75' ' ' ALA . 17.5 t70 -54.27 -41.94 69.41 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 111.023 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.83 -37.7 67.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.137 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -43.11 82.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.475 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.411 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.8 OUTLIER -58.18 -41.68 84.43 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.093 -179.309 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.573 ' HE2' ' HG3' ' B' ' 72' ' ' PRO . 12.2 tptp -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.164 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.97 -46.34 30.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.492 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -70.59 -51.86 25.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.798 -176.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.47 -34.32 50.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.898 0.38 . . . . 0.0 110.865 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.5 tptm -62.08 -36.08 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.395 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.62 -26.01 68.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.281 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.83 -31.91 71.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.656 176.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.57 ' HG2' ' HE3' ' A' ' 24' ' ' MET . 7.2 mtpp -75.86 -21.06 57.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.46 0.648 . . . . 0.0 110.819 173.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.46 46.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.279 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -75.64 -15.28 60.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.889 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.513 ' HB2' ' HE1' ' A' ' 22' ' ' MET . 1.5 mpp? -121.58 -179.45 4.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.965 0.412 . . . . 0.0 111.237 -177.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.5 t -88.22 105.81 15.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.61 175.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.796 ' HG3' ' HG2' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -73.45 100.04 3.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.856 0.36 . . . . 0.0 110.29 -177.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.473 HD21 ' HA ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -116.27 142.51 46.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.193 0.52 . . . . 0.0 111.127 -175.743 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.18 138.41 48.96 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.853 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.65 -14.46 3.28 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.697 2.932 . . . . 0.0 114.308 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.42 -45.78 52.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.836 0.351 . . . . 0.0 110.795 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.0 OUTLIER -79.6 -33.34 41.64 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.544 176.175 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.52 93.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.453 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.475 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 63.5 t80 -74.19 -32.56 63.12 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -51.55 67.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.521 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -73.85 -27.54 61.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.72 0.295 . . . . 0.0 110.864 178.509 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.738 HD12 ' HB2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.55 -50.59 72.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.207 0.527 . . . . 0.0 110.838 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -27.5 56.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -76.75 -31.9 57.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.77 0.319 . . . . 0.0 111.067 -177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . 0.731 ' HB2' HG13 ' A' ' 40' ' ' ILE . 44.6 m-20 -119.73 114.42 34.15 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.842 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 15.6 Cg_exo -68.74 -0.27 5.86 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.197 2.598 . . . . 0.0 112.925 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -105.36 -18.48 14.1 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.193 179.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.799 HG12 ' HG2' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -74.27 114.37 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.615 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.509 ' HB ' HG13 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -107.64 140.04 41.26 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.793 -177.085 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.738 ' HB2' HD12 ' A' ' 34' ' ' LEU . 10.7 tp -103.93 120.92 42.04 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.736 HD12 HD23 ' A' ' 79' ' ' LEU . 1.3 mp -104.35 113.74 42.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.609 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 2.2 t70 -102.47 140.25 37.0 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.725 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -122.75 93.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.622 0.725 . . . . 0.0 109.777 173.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.409 HH12 ' CD ' ' A' ' 50' ' ' GLU . 11.9 mmm180 -143.27 152.64 41.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.415 178.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.94 142.07 64.29 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.498 -173.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -59.86 -25.28 78.92 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 123.37 2.714 . . . . 0.0 113.565 -172.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.81 -38.45 46.47 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.212 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.409 ' CD ' HH12 ' A' ' 46' ' ' ARG . 0.4 OUTLIER -72.91 -37.44 67.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 175.268 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.943 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.3 tp -59.35 -33.31 71.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.519 174.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -37.59 60.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.132 178.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.48 -49.66 13.02 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -174.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -100.11 -35.8 9.55 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.289 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.15 178.48 15.33 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.459 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.943 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -140.58 154.06 68.83 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.433 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.6 Cg_endo -61.38 123.27 12.46 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 121.976 1.784 . . . . 0.0 112.674 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.508 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 46.7 t0 -86.54 93.56 9.21 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 174.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.603 ' CG2' ' HB2' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -129.84 151.42 35.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.234 -177.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.87 76.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.172 0.51 . . . . 0.0 110.911 -178.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -116.95 66.84 0.72 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.356 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.609 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 12.2 t80 -108.38 122.52 47.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.611 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HD3' ' HB3' ' A' ' 77' ' ' SER . 18.9 mttm -122.83 109.31 14.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -93.11 114.53 27.07 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' MET . . . . . 0.524 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 CA-C-O 120.841 0.353 . . . . 0.0 110.326 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.517 ' HG ' ' N ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.517 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -47.31 -53.89 25.49 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.369 -175.626 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.484 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 73.9 Cg_endo -73.76 -16.73 23.44 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.076 1.851 . . . . 0.0 112.983 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.524 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -88.44 -15.74 34.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.671 0.272 . . . . 0.0 111.021 -177.809 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.616 HD22 HD22 ' A' ' 102' ' ' LEU . 6.3 tp -58.42 -53.49 57.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.176 0.512 . . . . 0.0 111.024 -178.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.47 -27.06 62.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.317 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.6 -28.79 62.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.84 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.473 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 41.2 m -77.41 -38.08 50.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.14 0.495 . . . . 0.0 109.957 178.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.24 81.25 1.58 Allowed Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.269 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.736 HD23 HD12 ' A' ' 43' ' ' ILE . 29.1 mt -122.36 148.64 44.82 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.466 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -128.06 138.93 34.0 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -70.54 -0.82 8.14 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 122.919 2.413 . . . . 0.0 114.266 -170.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.548 ' HA ' ' HG3' ' A' ' 108' ' ' LYS . 38.3 mm-40 -100.03 9.34 43.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.133 0.492 . . . . 0.0 109.997 175.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.466 ' HG3' ' OD2' ' A' ' 80' ' ' ASP . 7.2 mttm -102.82 128.11 28.58 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.235 -178.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.799 ' HG2' HG12 ' A' ' 40' ' ' ILE . 72.9 Cg_endo -72.96 122.06 7.81 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.409 2.072 . . . . 0.0 110.806 174.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.509 HG13 ' HB ' ' A' ' 41' ' ' THR . 1.8 m -130.56 152.62 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.029 0.443 . . . . 0.0 111.371 -173.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.588 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 1.2 p -127.07 142.49 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 16.4 m -104.33 135.82 40.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.124 0.488 . . . . 0.0 110.556 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.686 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.9 t80 -119.48 144.65 46.88 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.753 -177.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' CYS . . . . . 0.585 ' HB3' ' HB1' ' A' ' 95' ' ' ALA . 52.7 t . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.446 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . 0.585 ' HB1' ' HB3' ' A' ' 89' ' ' CYS . . . . . . . . 0 CA--C 1.527 0.065 0 CA-C-O 121.117 0.484 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.71 -27.91 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.174 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -67.59 -35.27 78.67 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.407 179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.73 -45.63 50.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.913 0.387 . . . . 0.0 110.427 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.447 ' HA2' HD12 ' A' ' 110' ' ' ILE . . . -70.21 -53.45 13.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.57 -177.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.512 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -62.3 -35.81 80.19 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.704 -0.292 . . . . 0.0 111.408 -174.245 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.512 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 23.4 m -70.75 -35.57 72.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.826 0.346 . . . . 0.0 110.8 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.616 HD22 HD22 ' A' ' 74' ' ' LEU . 13.1 mt -66.36 -47.77 72.35 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.84 0.352 . . . . 0.0 111.083 177.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.613 ' HB3' HG23 ' A' ' 110' ' ' ILE . 0.6 OUTLIER -67.79 -26.17 65.96 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.966 0.413 . . . . 0.0 110.356 178.535 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -8.08 32.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.395 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -108.81 -12.03 14.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.576 0.226 . . . . 0.0 111.385 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.58 18.5 4.83 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.072 -1.061 . . . . 0.0 113.343 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -66.2 140.16 58.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.548 ' HG3' ' HA ' ' A' ' 82' ' ' GLU . 14.5 mtpp -62.69 -84.69 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.194 -171.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.39 109.85 19.36 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.686 -177.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.613 HG23 ' HB3' ' A' ' 103' ' ' ARG . 1.3 tt -114.71 128.74 71.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.154 0.502 . . . . 0.0 111.247 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.588 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 12.0 m-85 -113.36 139.67 48.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.433 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -115.98 144.41 44.11 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.05 130.12 34.87 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.867 -173.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.796 ' HG2' ' HG3' ' A' ' 24' ' ' MET . 0.0 OUTLIER -96.09 17.29 15.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.374 172.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.46 -70.63 0.12 Allowed Glycine 0 N--CA 1.442 -0.944 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.836 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 114.59 177.71 18.96 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.08 179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' MET . . . . . 0.546 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -57.73 -37.98 74.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.822 0.344 . . . . 0.0 111.11 -178.199 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.53 -28.52 70.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.505 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -75.38 -31.95 60.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.37 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.686 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -57.24 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.445 ' HG ' ' HE3' ' A' ' 117' ' ' MET . 62.4 mt -63.21 -37.4 87.08 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.555 175.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -60.23 -40.09 89.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.718 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.487 ' HB2' ' HG ' ' A' ' 125' ' ' LEU . 38.6 mm-40 -81.89 -3.08 53.3 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.251 -177.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.98 32.46 73.33 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.584 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 76.6 mt -78.82 163.26 61.58 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.359 -178.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.584 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 28.2 Cg_endo -57.53 113.26 1.42 Allowed 'Trans proline' 0 CA--C 1.517 -0.338 0 C-N-CA 122.824 2.35 . . . . 0.0 111.484 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.9 m -121.09 151.07 40.28 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . 0.756 ' HB3' ' HE2' ' A' ' 56' ' ' LYS . 1.3 mt -98.92 101.35 12.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.838 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--N 1.316 -0.862 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.318 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 1.6 ttm . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 120.62 0.248 . . . . 0.0 111.316 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' GLY . . . . . 0.701 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -55.13 -34.96 59.02 Favored Glycine 0 C--O 1.227 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.427 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.58 -32.24 71.34 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 122.946 0.498 . . . . 0.0 111.628 176.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -72.79 -57.93 3.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.133 -174.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . 0.701 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.3 p90 -74.75 -25.66 59.24 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.521 -176.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -53.71 -52.47 59.96 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 123.361 0.413 . . . . 0.0 110.553 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.81 -44.3 77.64 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.84 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' THR . . . . . 0.427 ' O ' ' HB1' ' B' ' 13' ' ' ALA . 0.5 OUTLIER -66.74 -42.29 86.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -175.658 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' PHE . . . . . 0.41 ' CE1' HD22 ' A' ' 70' ' ' LEU . 0.6 OUTLIER -53.5 -43.81 68.54 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.221 0.534 . . . . 0.0 110.704 -178.699 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' LYS . . . . . 0.464 ' HZ1' ' CD ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -67.38 -24.58 65.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.258 177.72 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . 0.427 ' HB1' ' O ' ' B' ' 10' ' ' THR . . . -72.66 -48.78 36.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.866 0.365 . . . . 0.0 110.81 176.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -67.69 -51.41 49.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.303 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.69 -34.1 41.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.935 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . 0.441 ' HB3' ' HE2' ' B' ' 16' ' ' LYS . 5.9 mtpt -66.63 -39.43 88.27 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.741 0.305 . . . . 0.0 111.16 176.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.93 -26.89 68.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.573 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.45 -33.3 64.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.116 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.64 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 0.1 OUTLIER -75.94 -21.25 57.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.125 0.488 . . . . 0.0 110.928 174.874 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.96 -19.16 61.94 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.026 -174.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.5 -1.18 57.62 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -176.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' MET . . . . . 0.629 ' HG3' HG21 ' B' ' 110' ' ' ILE . 1.5 mpp? -120.47 165.93 14.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.83 0.348 . . . . 0.0 111.343 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 15.4 t -80.99 103.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' MET . . . . . 0.781 ' HE1' ' HB3' ' B' ' 112' ' ' ASN . 0.5 OUTLIER -79.14 107.21 11.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.997 0.427 . . . . 0.0 110.672 -174.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.1 mt -126.73 142.08 51.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.662 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.48 151.8 85.33 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.203 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.421 ' HB2' ' CD1' ' B' ' 125' ' ' LEU . 4.7 Cg_endo -47.66 -31.33 14.14 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.854 3.036 . . . . 0.0 114.372 -177.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . 0.844 ' HD3' ' HG2' ' B' ' 123' ' ' GLU . 1.3 mtmm -74.43 -42.67 58.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.471 . . . . 0.0 110.791 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.94 -32.44 69.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.117 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.26 -44.05 69.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.464 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' TYR . . . . . 0.57 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.3 t80 -67.03 -30.47 70.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.204 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -57.09 -52.85 63.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.035 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.555 ' HB2' HD13 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -73.9 -27.75 61.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.677 178.321 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' B' ' 31' ' ' TYR . 1.1 mt -61.73 -55.8 26.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.945 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.06 -22.19 55.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.775 -173.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.84 -31.78 20.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.964 0.411 . . . . 0.0 110.555 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . 0.413 ' C ' ' H ' ' B' ' 39' ' ' ASP . 43.3 m-80 -121.3 102.94 42.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.437 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . 0.485 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 17.1 Cg_exo -68.27 5.81 1.08 Allowed 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.261 2.641 . . . . 0.0 112.545 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . 0.413 ' H ' ' C ' ' B' ' 37' ' ' ASN . 0.4 OUTLIER -91.83 -27.56 17.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.583 174.573 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.555 HD13 ' HB2' ' B' ' 33' ' ' LEU . 9.2 mt -82.37 109.2 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.688 175.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.2 m -100.25 145.22 28.35 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.672 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.539 HD11 HG12 ' B' ' 86' ' ' VAL . 12.2 tp -101.1 122.58 43.84 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' B' ' 87' ' ' VAL . 79.7 mt -103.85 111.16 32.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.213 176.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.819 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -98.96 129.43 45.27 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.68 96.64 4.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.366 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . 0.546 ' HG2' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -155.75 167.0 31.82 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.369 -177.464 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.433 ' H ' ' HD2' ' B' ' 46' ' ' ARG . 0.7 OUTLIER -75.6 125.66 88.31 Favored Pre-proline 0 C--N 1.314 -0.941 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.125 -176.439 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -65.43 -19.79 61.22 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.901 2.401 . . . . 0.0 113.472 -172.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.66 -46.15 73.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.975 0.417 . . . . 0.0 110.472 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.05 -34.07 66.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.582 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.837 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.5 OUTLIER -58.87 -45.77 89.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.467 0.651 . . . . 0.0 110.253 176.597 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -66.53 -37.01 84.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.4 -48.41 10.38 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -174.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.1 -35.79 11.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.932 -172.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 135.64 159.36 8.53 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.125 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' LYS . . . . . 0.837 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -139.49 154.99 72.04 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.06 123.23 13.36 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.278 1.986 . . . . 0.0 112.562 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -101.83 74.99 1.51 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.2 0.524 . . . . 0.0 109.954 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.42 HG13 ' CE1' ' B' ' 31' ' ' TYR . 3.1 m -115.95 167.92 8.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.837 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -41.53 99.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.942 -175.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.485 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 0.0 OUTLIER -122.49 77.34 1.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.362 0.601 . . . . 0.0 110.857 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' TYR . . . . . 0.819 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.2 t80 -122.57 127.8 49.91 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.749 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -123.29 124.57 43.27 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.876 176.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -88.11 128.34 35.42 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.733 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 173.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.263 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.478 ' H ' ' HG3' ' B' ' 71' ' ' GLU . 0.0 OUTLIER -50.24 -59.47 7.06 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.399 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . 0.573 ' HG3' ' HE2' ' A' ' 12' ' ' LYS . 3.9 Cg_exo -74.43 -15.85 22.04 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.605 2.203 . . . . 0.0 112.965 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.19 -6.22 58.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.607 0.242 . . . . 0.0 111.504 -174.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.491 HD22 ' CD1' ' A' ' 7' ' ' PHE . 6.0 tp -63.98 -54.87 27.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.555 -175.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.517 ' HB1' ' HB2' ' A' ' 8' ' ' ASP . . . -69.73 -23.62 63.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.891 0.377 . . . . 0.0 111.399 -179.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.91 -31.21 61.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.796 -177.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -73.93 -39.26 63.92 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.13 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.55 81.2 1.46 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.908 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.5 mt -123.45 142.54 50.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.657 0.265 . . . . 0.0 110.93 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . 0.496 ' OD2' ' HG2' ' B' ' 83' ' ' LYS . 0.0 OUTLIER -114.77 136.28 22.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.24 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.49 -0.37 2.93 Favored 'Trans proline' 0 N--CA 1.476 0.468 0 C-N-CA 123.078 2.519 . . . . 0.0 114.234 -172.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . 0.44 ' HB2' ' OD2' ' B' ' 80' ' ' ASP . 3.6 mm-40 -98.73 -11.59 21.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 0.0 110.717 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' LYS . . . . . 0.496 ' HG2' ' OD2' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -82.85 122.01 77.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.626 179.028 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.543 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 15.9 Cg_exo -63.94 132.7 35.6 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.363 2.042 . . . . 0.0 110.168 173.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.648 HG22 HD13 ' B' ' 110' ' ' ILE . 0.0 OUTLIER -131.58 143.01 41.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 120.893 0.378 . . . . 0.0 111.124 -173.414 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.539 HG12 HD11 ' B' ' 42' ' ' LEU . 0.7 OUTLIER -121.85 139.78 47.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 175.508 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' B' ' 43' ' ' ILE . 1.3 m -102.8 126.46 57.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.074 0.464 . . . . 0.0 110.33 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' PHE . . . . . 0.677 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 3.2 t80 -111.88 140.27 46.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.371 -174.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . 0.546 ' SG ' ' HG2' ' B' ' 46' ' ' ARG . 49.6 t . . . . . 0 N--CA 1.463 0.189 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.866 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.934 0.397 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.36 72.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.111 -176.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.78 -39.59 84.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.799 0.333 . . . . 0.0 110.93 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.99 -45.57 70.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.0 0.429 . . . . 0.0 110.237 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 99' ' ' GLY . . . . . 0.575 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -69.21 -50.47 33.17 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.54 -178.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 100' ' ' LYS . . . . . 0.601 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -60.96 -38.35 85.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -173.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 101' ' ' THR . . . . . 0.601 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 2.3 m -72.84 -35.91 67.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.614 0.245 . . . . 0.0 111.06 178.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 10.1 mt -62.94 -47.82 81.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.515 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 103' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -65.09 -26.75 68.36 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.906 0.384 . . . . 0.0 110.53 179.209 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . 0.42 ' CD ' ' HZ3' ' B' ' 100' ' ' LYS . 13.8 mt-10 -69.36 -7.45 37.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.828 177.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . 0.411 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 23.5 m-85 -103.36 -8.24 20.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 0.0 110.938 178.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.14 41.4 1.53 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.243 -0.979 . . . . 0.0 112.735 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -87.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.418 -175.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.17 119.62 35.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.879 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 110' ' ' ILE . . . . . 0.648 HD13 HG22 ' B' ' 85' ' ' VAL . 1.2 tt -119.46 126.58 75.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.252 0.549 . . . . 0.0 110.818 -176.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 111' ' ' TYR . . . . . 0.533 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 3.1 m-85 -112.95 141.67 46.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.866 -174.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . 0.781 ' HB3' ' HE1' ' B' ' 24' ' ' MET . 0.7 OUTLIER -112.26 139.51 47.74 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.301 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 113' ' ' SER . . . . . 0.499 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 0.3 OUTLIER -81.93 119.86 24.48 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -173.266 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . 0.554 ' CG ' ' HB3' ' B' ' 24' ' ' MET . 2.4 mm-40 -82.08 5.19 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.79 177.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -107.99 -99.06 2.59 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.012 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 155.18 166.74 15.82 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 117' ' ' MET . . . . . 0.459 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.1 OUTLIER -59.75 -39.19 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.006 0.431 . . . . 0.0 110.75 -178.208 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 18.6 p-10 -68.78 -23.85 64.35 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.83 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 119' ' ' LYS . . . . . 0.477 ' HD2' ' HA ' ' B' ' 119' ' ' LYS . 0.1 OUTLIER -73.67 -32.14 63.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.883 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 120' ' ' TRP . . . . . 0.677 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 27.7 t-105 -58.83 -51.46 69.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.736 177.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 11.5 mt -67.3 -40.12 86.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.144 178.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.2 OUTLIER -63.7 -45.93 87.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.665 -176.706 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . 0.844 ' HG2' ' HD3' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -83.69 17.05 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.646 -176.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 67.44 23.05 73.46 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.007 171.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.439 HD11 ' CD2' ' B' ' 120' ' ' TRP . 53.3 mt -75.29 154.54 86.15 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 117.101 0.451 . . . . 0.0 110.347 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -58.65 115.75 2.77 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.046 2.497 . . . . 0.0 112.219 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.17 150.59 52.0 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.181 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 128' ' ' LEU . . . . . 0.435 ' HB2' ' HG2' ' B' ' 56' ' ' LYS . 2.5 mt . . . . . 0 N--CA 1.445 -0.676 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.554 ' HG3' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 120.767 0.318 . . . . 0.0 110.331 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . 0.541 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -62.69 -39.8 98.38 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.783 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -65.03 -32.88 74.82 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.266 0.555 . . . . 0.0 110.289 176.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.554 ' HG3' ' HG3' ' A' ' 3' ' ' MET . 17.0 mmtt -64.78 -57.5 8.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 112.252 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.541 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.8 p90 -80.43 -26.65 38.29 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 119.788 -0.765 . . . . 0.0 112.065 -174.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . 0.451 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . 16.0 t70 -53.85 -51.18 64.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.959 0.409 . . . . 0.0 111.176 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.388 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -68.57 -40.62 80.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.932 -175.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . 0.411 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.5 OUTLIER -57.86 -45.96 85.54 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.194 0.521 . . . . 0.0 110.293 -178.402 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.544 ' HD3' ' HG3' ' B' ' 72' ' ' PRO . 1.2 tptp -65.31 -24.98 67.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.083 175.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.18 -44.54 46.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.227 178.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -71.51 -51.3 24.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.613 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.24 -33.63 43.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.979 0.419 . . . . 0.0 110.869 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -37.4 70.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.356 177.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.35 -26.04 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.028 0.442 . . . . 0.0 111.551 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.04 -31.63 66.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.06 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.466 ' HD2' ' HE1' ' A' ' 24' ' ' MET . 32.2 mtmt -76.14 -22.43 55.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.42 0.628 . . . . 0.0 110.579 173.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.15 58.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.865 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -76.85 -9.12 58.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.886 -176.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.445 ' HE1' ' HB2' ' A' ' 22' ' ' MET . 0.7 OUTLIER -127.98 171.6 11.69 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.128 -0.357 . . . . 0.0 111.299 -177.363 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -84.49 109.66 18.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' MET . . . . . 0.842 ' HE2' ' HG2' ' A' ' 114' ' ' GLU . 0.6 OUTLIER -78.02 103.47 7.98 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.7 -174.739 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.583 ' O ' ' HA ' ' A' ' 113' ' ' SER . 7.5 mt -121.1 140.89 51.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.157 0.503 . . . . 0.0 111.316 -177.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 141.77 76.15 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.052 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -44.51 -30.12 3.7 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 124.203 3.269 . . . . 0.0 114.636 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.451 ' HG2' ' OE2' ' A' ' 123' ' ' GLU . 0.4 OUTLIER -73.65 -42.59 61.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.941 0.4 . . . . 0.0 111.142 178.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.38 -33.25 69.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.212 177.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.421 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -65.98 -47.46 74.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.082 176.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TYR . . . . . 0.632 ' HA ' HD11 ' A' ' 34' ' ' LEU . 51.6 t80 -64.2 -30.53 71.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.076 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -52.61 64.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.022 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.509 ' HB2' HD11 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -73.73 -27.42 61.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.886 178.758 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.632 HD11 ' HA ' ' A' ' 31' ' ' TYR . 35.2 mt -62.32 -54.65 37.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.302 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLN . . . . . 0.449 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -76.39 -28.03 56.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.04 -174.348 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.449 ' N ' ' HG3' ' A' ' 35' ' ' GLN . 17.7 mt-10 -79.74 -34.13 40.23 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.222 0.534 . . . . 0.0 110.426 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -117.53 94.58 45.92 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.718 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -60.87 -2.83 2.36 Favored 'Trans proline' 0 N--CA 1.474 0.381 0 C-N-CA 123.201 2.6 . . . . 0.0 113.921 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -96.98 -18.92 19.13 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.955 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.602 HG23 HD22 ' A' ' 34' ' ' LEU . 23.5 mt -77.25 108.59 10.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.33 145.2 28.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.515 -173.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.489 HD13 ' HB2' ' A' ' 88' ' ' PHE . 7.8 tp -103.85 129.2 51.29 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.573 HD12 HD23 ' A' ' 79' ' ' LEU . 1.3 mp -112.7 121.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.091 0.472 . . . . 0.0 109.876 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.799 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -98.38 138.87 34.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.844 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.97 95.33 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.489 0.662 . . . . 0.0 109.462 174.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 1.8 tpt85 -152.24 163.85 38.57 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.274 -0.876 . . . . 0.0 108.774 -179.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.49 139.92 31.81 Favored Pre-proline 0 C--N 1.322 -0.61 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.15 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -62.09 -19.32 65.97 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.322 2.681 . . . . 0.0 115.059 -166.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.45 ' HB2' ' OE2' ' B' ' 50' ' ' GLU . 0.1 OUTLIER -76.7 -39.2 52.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.041 -0.664 . . . . 0.0 111.386 -178.927 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.19 -37.55 66.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.455 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.8 OUTLIER -59.34 -45.84 90.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.234 0.54 . . . . 0.0 110.912 177.327 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -35.52 80.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.85 -177.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.87 -48.52 12.26 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -175.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -92.62 -36.79 12.79 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.578 -0.449 . . . . 0.0 112.199 -173.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.3 173.19 13.51 Favored Glycine 0 N--CA 1.44 -1.097 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.819 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LYS . . . . . 0.553 ' HB2' ' HD2' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -149.04 165.7 17.09 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.729 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.553 ' HD2' ' HB2' ' A' ' 56' ' ' LYS . 18.6 Cg_endo -63.78 123.63 12.3 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 121.881 1.72 . . . . 0.0 112.387 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -94.16 71.97 3.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.072 0.463 . . . . 0.0 110.044 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.452 HG21 ' HB3' ' A' ' 62' ' ' TYR . 4.5 m -115.94 174.41 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.34 -24.27 32.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.812 0.339 . . . . 0.0 111.383 -176.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -125.43 66.45 1.15 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.384 0.612 . . . . 0.0 111.335 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' TYR . . . . . 0.799 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 0.8 OUTLIER -132.84 139.13 47.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.623 177.332 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.449 ' HE3' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -135.36 135.72 40.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.975 0.417 . . . . 0.0 110.533 176.399 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.0 t-160 -93.18 115.63 28.25 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.493 178.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.403 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 178.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.514 HD13 HD12 ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.952 ' HB3' ' HB3' ' B' ' 11' ' ' PHE . 0.0 OUTLIER -45.01 -57.62 6.85 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.757 -174.603 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.492 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 74.0 Cg_endo -73.65 -15.87 24.14 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.051 1.834 . . . . 0.0 112.605 178.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.526 HD21 ' HA ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -81.29 -22.32 38.68 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.283 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.542 HD22 HD22 ' A' ' 102' ' ' LEU . 3.7 tp -58.31 -53.16 61.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.137 177.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.01 -27.38 68.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.585 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.91 -22.54 39.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.755 0.312 . . . . 0.0 111.235 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' SER . . . . . 0.431 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 49.8 m -79.57 -35.82 39.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.9 -177.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.18 63.39 1.04 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.521 -0.847 . . . . 0.0 111.869 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . 0.573 HD23 HD12 ' A' ' 43' ' ' ILE . 43.7 mt -110.45 136.67 49.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.574 0.226 . . . . 0.0 110.408 -179.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASP . . . . . 0.489 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -121.52 138.81 28.81 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.238 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PRO . . . . . 0.407 ' HG3' ' SD ' ' B' ' 3' ' ' MET . 31.9 Cg_endo -68.56 8.01 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.903 2.402 . . . . 0.0 113.719 -174.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -102.27 -17.44 15.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 122.106 -0.371 . . . . 0.0 110.616 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.489 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -93.69 126.19 50.64 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.684 178.499 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.616 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 18.1 Cg_exo -65.36 143.75 77.68 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.769 2.313 . . . . 0.0 111.362 177.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.802 HG22 HD13 ' A' ' 110' ' ' ILE . 2.4 m -137.72 149.65 25.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.076 0.465 . . . . 0.0 111.046 -178.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.558 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 0.7 OUTLIER -125.74 142.91 41.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.488 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.502 ' N ' HG21 ' A' ' 86' ' ' VAL . 2.9 m -103.4 134.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.951 0.405 . . . . 0.0 110.608 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' PHE . . . . . 0.609 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.0 OUTLIER -120.12 141.47 49.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.939 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 46.8 t . . . . . 0 C--O 1.235 0.309 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.887 177.696 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.257 0 CA-C-O 120.971 0.415 . . . . 0.0 111.299 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -28.56 69.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.287 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.74 -38.89 92.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.695 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.9 -46.76 33.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.693 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLY . . . . . 0.547 ' HA2' HD12 ' A' ' 110' ' ' ILE . . . -65.46 -55.48 20.47 Favored Glycine 0 CA--C 1.519 0.299 0 C-N-CA 121.058 -0.591 . . . . 0.0 113.57 -176.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LYS . . . . . 0.532 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -61.86 -32.86 73.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.813 0.34 . . . . 0.0 111.199 -174.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' THR . . . . . 0.477 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 44.1 m -72.88 -38.74 66.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.782 0.325 . . . . 0.0 110.974 177.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . 0.542 HD22 HD22 ' A' ' 74' ' ' LEU . 11.6 mt -64.3 -45.2 89.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.47 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.1 -27.47 68.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.919 0.39 . . . . 0.0 110.597 179.157 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.19 -6.73 41.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.368 178.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' TYR . . . . . 0.45 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 22.6 m-85 -104.21 -5.42 21.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.784 0.326 . . . . 0.0 110.543 176.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 107.07 34.61 2.93 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.952 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -78.23 139.27 38.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.682 0.277 . . . . 0.0 110.44 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -60.85 3.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.751 -172.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.616 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -139.23 120.01 14.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.294 -178.573 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ILE . . . . . 0.802 HD13 HG22 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -121.37 127.16 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.23 0.538 . . . . 0.0 111.397 -176.712 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.558 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 1.9 m-85 -118.52 145.76 45.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.261 -176.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ASN . . . . . 0.713 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 38.4 t-20 -117.12 143.41 45.84 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.583 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -97.23 115.46 27.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -172.851 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLU . . . . . 0.842 ' HG2' ' HE2' ' A' ' 24' ' ' MET . 2.9 mm-40 -76.32 33.96 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 113' ' ' SER . . . -139.84 -78.44 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.315 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 114.02 178.8 19.14 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.548 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' MET . . . . . 0.405 ' SD ' ' HD3' ' A' ' 57' ' ' PRO . 10.4 tpp -53.61 -38.49 64.07 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.017 0.437 . . . . 0.0 111.178 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -58.48 -41.66 85.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.573 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.8 -32.66 63.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.355 179.598 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.609 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -61.11 -53.66 54.26 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 9.1 mt -63.68 -42.19 98.06 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.109 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.41 -41.49 93.53 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.804 -177.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLU . . . . . 0.559 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -67.08 -21.2 65.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.913 0.387 . . . . 0.0 110.972 -177.343 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 90.5 21.87 36.14 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.883 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . 0.559 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 24.3 mt -75.97 159.53 80.54 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 177.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.489 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 14.4 Cg_endo -54.17 114.03 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.973 2.449 . . . . 0.0 111.704 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.05 148.78 41.93 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 120.991 0.424 . . . . 0.0 110.698 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.5 mt -97.02 100.77 12.26 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.312 -1.038 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -175.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' MET . . . . . 0.412 ' HG2' ' HG3' ' B' ' 6' ' ' LYS . 14.1 mtp . . . . . 0 C--O 1.233 0.201 0 CA-C-O 120.654 0.264 . . . . 0.0 111.374 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' GLY . . . . . 0.587 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.49 -35.03 78.04 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.319 -0.467 . . . . 0.0 113.434 -177.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.83 -31.88 66.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.012 0.434 . . . . 0.0 110.561 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' B' ' 6' ' ' LYS . 6.2 mmtt -71.31 -57.8 4.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.134 -173.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . 0.587 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.6 p90 -73.01 -35.59 66.84 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.103 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.33 -56.08 22.1 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.83 0.348 . . . . 0.0 110.877 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.08 -46.55 85.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.801 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.53 -41.87 92.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.536 -177.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' PHE . . . . . 0.952 ' HB3' ' HB3' ' A' ' 71' ' ' GLU . 0.3 OUTLIER -54.11 -43.89 70.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.217 0.532 . . . . 0.0 110.525 -178.045 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -65.24 -24.43 67.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.619 177.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.41 -49.78 21.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.38 . . . . 0.0 110.853 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -71.33 -52.0 21.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.896 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.29 -33.47 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.146 -177.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -70.94 -34.92 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.2 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -26.74 68.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.934 0.397 . . . . 0.0 111.065 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.17 72.03 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.631 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' LYS . . . . . 0.517 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 6.9 mtmt -76.07 -22.38 55.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.351 0.596 . . . . 0.0 111.008 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.28 -19.02 61.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.122 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.62 -5.46 56.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.527 -177.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' MET . . . . . 0.523 ' HE1' ' HB2' ' B' ' 22' ' ' MET . 1.5 mpp? -122.16 176.33 5.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.567 0.222 . . . . 0.0 110.79 -179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 31.5 t -88.37 105.03 15.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' MET . . . . . 0.517 ' SD ' ' HB3' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -75.68 111.28 10.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.998 0.428 . . . . 0.0 110.767 -175.223 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' LEU . . . . . 0.427 ' HA ' HD21 ' B' ' 25' ' ' LEU . 5.2 mt -124.17 144.29 50.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.081 -176.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.15 146.04 61.97 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.547 176.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -51.52 -21.56 10.84 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.522 2.815 . . . . 0.0 114.104 -175.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -75.03 -47.45 28.95 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.053 0.454 . . . . 0.0 110.821 175.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.02 -32.63 72.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.82 -47.79 61.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.967 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' TYR . . . . . 0.486 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 86.2 t80 -67.02 -29.73 69.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.748 178.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.96 -53.51 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.82 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -74.08 -27.59 60.97 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.01 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . 0.49 HD22 ' O ' ' B' ' 40' ' ' ILE . 0.2 OUTLIER -62.53 -45.84 91.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.136 178.454 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -75.87 -26.99 57.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.487 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 -29.43 26.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.813 0.339 . . . . 0.0 110.771 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -125.68 98.73 33.77 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.268 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.64 2.74 1.8 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.13 2.554 . . . . 0.0 112.871 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -90.33 -20.77 22.51 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ILE . . . . . 0.583 HG12 ' HB2' ' B' ' 84' ' ' PRO . 41.1 mt -80.22 112.52 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.123 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' THR . . . . . 0.424 ' HB ' HG11 ' B' ' 85' ' ' VAL . 1.9 m -94.72 140.64 29.62 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.057 -178.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . 0.615 HD12 ' HB2' ' B' ' 88' ' ' PHE . 8.0 tp -105.12 123.82 48.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' ILE . . . . . 0.597 HD12 HD12 ' B' ' 79' ' ' LEU . 2.1 mp -110.29 115.53 49.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.573 177.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' ASP . . . . . 0.786 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.3 OUTLIER -99.06 140.51 33.11 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.553 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.87 94.7 2.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.655 0.741 . . . . 0.0 109.84 174.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' ARG . . . . . 0.647 ' HD3' ' SD ' ' B' ' 117' ' ' MET . 21.0 mtp85 -145.44 164.18 32.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.362 178.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -73.28 134.25 80.27 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.242 -173.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -65.05 -21.39 63.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.449 2.766 . . . . 0.0 114.621 -169.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.35 -31.31 48.5 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.251 -0.579 . . . . 0.0 110.268 177.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' GLU . . . . . 0.45 ' OE2' ' HB2' ' A' ' 49' ' ' ASP . 2.3 mm-40 -70.91 -40.88 71.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.046 173.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.453 HD13 ' HE2' ' B' ' 117' ' ' MET . 0.5 OUTLIER -60.2 -33.57 72.42 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.605 176.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -39.12 54.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.512 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.47 -46.83 13.98 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 4.1 mtm -97.65 -35.06 10.71 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.716 -0.393 . . . . 0.0 111.5 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.42 173.17 14.2 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.262 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' LYS . . . . . 0.429 ' HG2' ' HB2' ' B' ' 128' ' ' LEU . 0.0 OUTLIER -138.82 156.73 72.65 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.401 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' PRO . . . . . 0.48 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 16.4 Cg_endo -60.8 125.21 16.64 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.647 2.231 . . . . 0.0 112.956 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . 0.792 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 17.7 t0 -97.5 96.3 8.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.236 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' VAL . . . . . 0.563 ' CG2' ' HB2' ' B' ' 62' ' ' TYR . 34.9 m -130.89 164.65 33.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.302 176.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -38.95 77.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.564 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -124.6 75.89 1.45 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.14 0.495 . . . . 0.0 110.851 -177.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' TYR . . . . . 0.786 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 13.5 t80 -118.08 126.02 51.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.451 -178.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . 0.591 ' HE3' HD22 ' B' ' 79' ' ' LEU . 15.4 mttm -128.04 120.48 27.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.964 0.412 . . . . 0.0 110.346 178.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' HIS . . . . . 0.484 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 11.5 t-160 -95.83 114.2 25.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' MET . . . . . 0.441 ' SD ' ' HA ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.614 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 177.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' LEU . . . . . 0.56 HD12 ' HB3' ' B' ' 98' ' ' ALA . 0.1 OUTLIER . . . . . 0 CA--C 1.514 -0.407 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' GLU . . . . . 0.516 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.3 -60.32 4.21 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.295 -175.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' PRO . . . . . 0.544 ' HG3' ' HD3' ' A' ' 12' ' ' LYS . 3.5 Cg_exo -74.66 -16.36 21.16 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.692 2.261 . . . . 0.0 112.916 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -91.11 -21.74 21.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.678 0.275 . . . . 0.0 111.458 -174.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' LEU . . . . . 0.441 ' HA ' ' SD ' ' B' ' 65' ' ' MET . 3.4 tp -61.02 -51.27 69.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.607 -173.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' ALA . . . . . 0.451 ' CB ' ' HB2' ' A' ' 8' ' ' ASP . . . -74.1 -17.49 60.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -76.15 -24.7 54.84 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -176.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.64 -28.0 51.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.8 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.67 83.41 1.56 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.303 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . 0.597 HD12 HD12 ' B' ' 43' ' ' ILE . 12.0 mt -126.0 144.68 50.61 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.199 -0.296 . . . . 0.0 110.199 179.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -114.11 130.51 23.85 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' PRO . . . . . 0.641 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 33.8 Cg_endo -68.47 -6.81 18.55 Favored 'Trans proline' 0 N--CA 1.472 0.255 0 C-N-CA 122.921 2.414 . . . . 0.0 113.912 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -98.95 2.58 46.57 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.42 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -106.76 142.66 25.44 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.132 177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' PRO . . . . . 0.583 ' HB2' HG12 ' B' ' 40' ' ' ILE . 16.9 Cg_exo -69.35 134.71 29.53 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.545 2.163 . . . . 0.0 111.859 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' VAL . . . . . 0.478 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 5.6 m -135.65 147.91 28.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.39 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' VAL . . . . . 0.457 ' HB ' ' CD1' ' B' ' 111' ' ' TYR . 0.5 OUTLIER -126.5 141.42 46.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.784 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' VAL . . . . . 0.447 ' N ' HG21 ' B' ' 86' ' ' VAL . 3.3 m -103.28 122.1 55.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.057 0.456 . . . . 0.0 110.062 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' PHE . . . . . 0.646 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 7.3 t80 -110.28 143.87 39.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.702 -175.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 53.4 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.92 177.111 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.932 0.396 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.97 -28.99 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.513 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -40.4 90.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.965 0.412 . . . . 0.0 110.502 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 98' ' ' ALA . . . . . 0.56 ' HB3' HD12 ' B' ' 70' ' ' LEU . . . -70.37 -40.42 74.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.72 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 99' ' ' GLY . . . . . 0.555 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -76.92 -49.87 7.36 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.799 -0.715 . . . . 0.0 113.615 -176.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 100' ' ' LYS . . . . . 0.581 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -64.79 -30.14 71.14 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.558 -0.378 . . . . 0.0 111.873 -172.238 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 3.2 m -72.03 -35.9 69.52 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.12 0.486 . . . . 0.0 110.163 175.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 102' ' ' LEU . . . . . 0.424 HD23 HD22 ' B' ' 74' ' ' LEU . 9.2 mt -67.1 -42.69 84.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.736 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 103' ' ' ARG . . . . . 0.581 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -62.25 -27.28 68.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.986 0.422 . . . . 0.0 110.497 179.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -6.75 42.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.736 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -104.38 -7.99 19.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.836 0.351 . . . . 0.0 110.634 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 111.52 15.28 10.49 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.655 175.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 107' ' ' PHE . . . . . 0.641 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 6.7 m-85 -61.88 125.79 25.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.793 0.33 . . . . 0.0 110.495 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -76.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.077 -172.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 109' ' ' THR . . . . . 0.56 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -117.33 104.4 11.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.523 -174.172 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 110' ' ' ILE . . . . . 0.555 HD12 ' HA2' ' B' ' 99' ' ' GLY . 1.5 tt -114.97 125.75 72.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.164 0.507 . . . . 0.0 110.967 -176.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 111' ' ' TYR . . . . . 0.457 ' CD1' ' HB ' ' B' ' 86' ' ' VAL . 1.1 m-85 -115.3 143.79 44.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.776 -175.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -114.28 143.34 45.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 88.7 p -79.74 129.09 34.18 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.839 0.352 . . . . 0.0 111.53 -172.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -97.61 8.18 45.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.082 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -122.3 -96.16 1.33 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.741 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 156.64 172.81 24.37 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.007 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 117' ' ' MET . . . . . 0.647 ' SD ' ' HD3' ' B' ' 46' ' ' ARG . 36.1 ttm -62.25 -35.38 78.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.08 0.467 . . . . 0.0 110.22 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -33.56 74.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.194 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.01 -33.81 66.0 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.035 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 120' ' ' TRP . . . . . 0.646 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.6 t-105 -58.68 -51.9 67.97 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 18.7 mt -62.93 -40.01 96.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.992 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.71 -43.33 80.3 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.335 -175.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.4 0.87 10.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.663 0.268 . . . . 0.0 111.244 -176.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 76.74 24.43 67.29 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.043 -0.598 . . . . 0.0 112.337 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 125' ' ' LEU . . . . . 0.528 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 77.6 mt -77.39 161.29 73.06 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 126' ' ' PRO . . . . . 0.528 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 38.2 Cg_endo -66.86 129.86 21.82 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.781 2.321 . . . . 0.0 112.29 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.74 148.73 52.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.814 0.34 . . . . 0.0 110.773 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 128' ' ' LEU . . . . . 0.792 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.7 mt . . . . . 0 C--N 1.325 -0.465 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.112 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -167.72 42.62 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.741 -171.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.559 ' SD ' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -80.34 19.36 0.78 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.03 -176.304 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.649 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -58.95 -38.32 92.55 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.961 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -71.42 -38.67 71.39 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.985 0.421 . . . . 0.0 110.488 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.559 ' HG3' ' SD ' ' A' ' 3' ' ' MET . 7.7 mmtt -60.54 -56.37 22.2 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.534 -176.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.649 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 1.1 p90 -76.46 -21.96 55.19 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 119.89 -0.724 . . . . 0.0 111.793 -175.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.603 ' HB2' ' HB3' ' B' ' 75' ' ' ALA . 0.0 OUTLIER -52.45 -46.11 66.34 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 123.447 0.467 . . . . 0.0 111.013 -178.103 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.43 -42.03 81.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.342 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.482 ' HB ' ' CE1' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -67.61 -43.13 81.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.287 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.619 ' HA ' ' HH ' ' B' ' 105' ' ' TYR . 0.6 OUTLIER -57.69 -44.45 85.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.301 179.282 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.648 ' HD2' ' HG3' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -66.46 -26.52 67.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.373 178.117 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.86 -42.37 63.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.078 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.0 -51.03 23.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.173 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.423 ' O ' HG11 ' A' ' 15' ' ' VAL . 2.1 t -64.77 -38.37 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.237 -173.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.648 ' HG3' ' HD2' ' A' ' 12' ' ' LYS . 0.9 OUTLIER -69.55 -32.62 71.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 0.0 111.368 -177.808 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.24 -26.12 66.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.384 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.38 -36.11 80.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.136 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.03 -22.28 49.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.288 0.566 . . . . 0.0 110.962 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.43 -19.13 50.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.544 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.78 -33.81 75.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.12 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.66 ' HB3' ' HD3' ' A' ' 103' ' ' ARG . 8.6 ptm -116.99 -172.61 2.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.211 0.529 . . . . 0.0 112.274 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.6 t -79.84 112.96 18.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.272 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 120.97 29.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.019 0.437 . . . . 0.0 110.491 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.3 mt -118.2 -168.47 1.53 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.902 -179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -126.61 144.13 48.7 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 173.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.415 ' HB2' ' CD1' ' A' ' 125' ' ' LEU . 1.2 Cg_endo -46.77 -30.37 9.19 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 123.933 3.089 . . . . 0.0 114.209 -174.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm -75.02 -43.8 51.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.943 0.401 . . . . 0.0 110.792 176.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.2 -32.24 73.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.393 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.634 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.01 -47.97 40.42 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.78 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.662 ' HA ' HD11 ' A' ' 34' ' ' LEU . 83.9 t80 -62.97 -33.41 75.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.862 178.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -53.9 -52.57 60.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.187 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.49 ' HB2' HD11 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -74.05 -26.18 60.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.364 179.756 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.662 HD11 ' HA ' ' A' ' 31' ' ' TYR . 99.0 mt -65.64 -48.77 71.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 111.275 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -75.69 -28.55 58.69 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.707 -174.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -86.59 -37.02 18.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.11 0.481 . . . . 0.0 110.511 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -116.48 97.43 50.0 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.77 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.498 ' HA ' ' ND2' ' A' ' 61' ' ' ASN . 35.7 Cg_endo -67.02 3.73 1.45 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 122.912 2.408 . . . . 0.0 112.902 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -91.38 -27.94 18.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.015 0.436 . . . . 0.0 110.24 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.518 HG12 ' HG2' ' A' ' 84' ' ' PRO . 25.0 mt -81.88 109.74 16.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.817 175.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.424 ' CG2' ' HB2' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -99.08 145.65 26.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.697 -175.16 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.604 HD13 ' HB2' ' A' ' 88' ' ' PHE . 2.7 tp -101.44 133.26 46.34 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.46 HD12 HD12 ' A' ' 79' ' ' LEU . 84.6 mt -112.77 117.1 54.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.529 176.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.831 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.1 OUTLIER -99.21 138.38 36.4 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.666 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.481 HG13 ' HE2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -126.17 98.73 5.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.534 177.479 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.822 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -156.76 162.89 39.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.445 178.551 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.822 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 3.4 m-20 -80.68 157.97 71.45 Favored Pre-proline 0 C--N 1.318 -0.777 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.162 -174.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.434 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 36.6 Cg_endo -72.1 -23.1 21.83 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.859 2.373 . . . . 0.0 114.758 -170.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.446 ' HB2' ' HG3' ' B' ' 50' ' ' GLU . 3.7 t70 -78.14 -37.86 45.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.704 -0.798 . . . . 0.0 111.763 -177.002 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.4 ' CD ' HH21 ' A' ' 46' ' ' ARG . 1.4 tt0 -70.53 -39.28 74.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.749 175.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.84 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 mp -59.56 -34.8 73.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.293 177.059 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -78.94 -45.13 21.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.164 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.54 -47.97 13.43 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 6.4 mmm -98.63 -36.25 9.94 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.629 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 173.3 14.15 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.536 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.84 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -143.64 162.28 42.42 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.199 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.462 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.5 Cg_endo -59.53 133.34 51.2 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.391 2.061 . . . . 0.0 113.156 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -95.9 95.36 8.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.063 174.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.666 ' CG2' ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -129.88 145.08 36.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.289 -178.377 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.84 95.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.308 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.498 ' ND2' ' HA ' ' A' ' 38' ' ' PRO . 0.8 OUTLIER -110.89 76.8 1.0 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.255 -178.566 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.831 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 4.9 t80 -120.34 125.92 49.22 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.162 -171.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.42 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 2.6 mtmt -122.88 113.12 18.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 174.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -92.39 113.08 25.25 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.967 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -114.01 103.31 11.02 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.744 -174.84 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.523 ' HB2' ' H ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -91.96 -105.09 0.11 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -174.145 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.617 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER 57.1 -131.64 1.51 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 -171.624 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.594 ' O ' ' HA ' ' B' ' 92' ' ' ALA . . . -95.25 -45.33 3.05 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 119.449 -1.358 . . . . 0.0 110.754 174.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.967 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -152.05 43.09 0.7 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.742 -0.229 . . . . 0.0 110.81 173.097 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.967 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 70.54 -2.52 2.18 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.06 -0.973 . . . . 0.0 113.13 173.594 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.608 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.2 OUTLIER -45.88 -63.94 1.1 Allowed Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.622 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.617 ' HG2' ' HG2' ' A' ' 67' ' ' ARG . 7.7 Cg_exo -74.49 -16.11 21.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.4 2.066 . . . . 0.0 113.159 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.776 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.8 OUTLIER -90.71 -15.66 29.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.33 -175.255 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.692 HD22 ' CD1' ' B' ' 7' ' ' PHE . 42.8 tp -57.13 -53.28 59.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.3 0.571 . . . . 0.0 110.729 -178.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -69.39 -22.6 63.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.357 -179.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.545 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 4.3 mttm -73.8 -30.12 62.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.765 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.519 ' HB3' ' HE3' ' A' ' 65' ' ' MET . 0.0 OUTLIER -78.18 -37.36 45.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.94 0.4 . . . . 0.0 110.449 -178.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.98 86.8 1.97 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.627 -176.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.46 HD12 HD12 ' A' ' 43' ' ' ILE . 1.0 OUTLIER -129.48 145.12 51.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.872 0.368 . . . . 0.0 111.097 -177.716 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -129.15 146.58 61.39 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.449 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 40.9 Cg_endo -69.77 9.19 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.987 2.458 . . . . 0.0 113.872 -175.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.49 18.61 15.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.322 0.582 . . . . 0.0 110.004 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.414 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -111.63 127.37 26.98 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.442 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.518 ' HG2' HG12 ' A' ' 40' ' ' ILE . 5.9 Cg_exo -75.57 129.35 11.76 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.426 2.084 . . . . 0.0 111.172 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.616 HG22 HD13 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -139.11 151.04 23.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.053 -177.183 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.494 HG21 ' N ' ' A' ' 87' ' ' VAL . 2.8 p -127.32 144.83 36.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.494 ' N ' HG21 ' A' ' 86' ' ' VAL . 8.2 m -112.15 142.24 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.734 0.302 . . . . 0.0 110.725 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.764 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.0 OUTLIER -108.69 158.2 17.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.495 -178.667 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER 67.47 62.75 0.44 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.417 0.627 . . . . 0.0 111.481 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.748 ' HA ' ' HB1' ' A' ' 95' ' ' ALA . 0.3 OUTLIER -62.35 -49.37 75.87 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -174.78 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.49 HG23 ' HA3' ' B' ' 68' ' ' GLY . 0.0 OUTLIER -76.5 -86.08 0.05 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -168.022 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.71 -56.84 15.76 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -172.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -64.82 -26.92 68.55 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.436 -179.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.418 ' HD3' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER 74.87 58.45 0.07 Allowed 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.541 178.423 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.748 ' HB1' ' HA ' ' A' ' 90' ' ' LYS . . . -64.01 -20.86 66.21 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 109.908 172.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -33.49 70.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.712 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -74.23 -30.39 62.15 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.34 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.84 -40.73 54.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.745 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.577 ' HA3' ' HE2' ' A' ' 22' ' ' MET . . . -93.47 -46.12 3.31 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.518 -0.849 . . . . 0.0 113.598 -172.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.481 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.41 -24.24 67.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.705 0.288 . . . . 0.0 111.227 -174.29 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.43 -49.65 66.01 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.442 175.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.57 HD22 HD23 ' A' ' 74' ' ' LEU . 39.4 mt -58.48 -41.95 86.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.446 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.66 ' HD3' ' HB3' ' A' ' 22' ' ' MET . 0.0 OUTLIER -71.53 -27.12 62.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 0.0 110.578 177.356 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.38 -9.35 58.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.705 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.479 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 19.4 m-85 -100.24 -40.86 7.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 144.56 41.13 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.259 175.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 4.0 m-85 -88.05 138.76 31.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.931 0.366 . . . . 0.0 110.367 177.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -61.32 -72.83 0.11 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.874 -174.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.86 107.44 10.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.064 0.459 . . . . 0.0 111.247 -176.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.616 HD13 HG22 ' A' ' 85' ' ' VAL . 1.2 tt -117.61 132.73 66.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.566 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -115.0 146.09 41.59 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.578 -177.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.421 ' OD1' ' HB3' ' A' ' 90' ' ' LYS . 5.7 t-20 -113.21 141.33 47.09 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 172.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -96.31 111.71 23.69 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.732 0.301 . . . . 0.0 111.806 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 115' ' ' GLY . 1.8 tp10 -62.05 149.7 40.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.099 177.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.586 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 89.86 -108.4 3.51 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.583 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.53 -161.46 32.68 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' MET . . . . . 0.426 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 35.9 tpp -60.5 -32.65 71.65 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.042 0.448 . . . . 0.0 110.725 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -61.79 -33.91 74.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.268 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.586 ' HD3' ' HA3' ' A' ' 115' ' ' GLY . 0.0 OUTLIER -73.85 -33.13 63.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 111.42 0.155 . . . . 0.0 111.42 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.764 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -62.77 -54.04 45.11 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 15.6 mt -62.12 -43.81 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.378 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.419 ' CD ' ' HZ3' ' A' ' 119' ' ' LYS . 1.4 pt-20 -74.79 -33.42 62.25 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -172.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -76.94 3.24 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 122.269 -0.269 . . . . 0.0 111.669 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.11 18.55 74.33 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.359 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.422 HD11 ' CD2' ' A' ' 120' ' ' TRP . 86.8 mt -76.52 154.24 83.75 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-O 120.834 0.349 . . . . 0.0 110.552 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.457 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 26.4 Cg_endo -57.98 111.25 0.79 Allowed 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 123.066 2.511 . . . . 0.0 111.951 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.84 146.97 47.08 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.88 101.55 13.24 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.02 142.45 49.57 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.915 -175.529 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.71 70.06 10.75 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.52 104.51 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.983 -176.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -122.5 136.17 54.82 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.616 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -116.48 -3.25 11.88 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.579 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 23.6 t60 -80.09 64.87 5.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.024 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -163.96 130.43 3.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.083 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.47 -52.59 2.77 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 173.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.254 1.339 0 CA-C-O 117.61 -1.186 . . . . 0.0 108.777 172.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.058 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -149.35 127.78 12.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.354 0.597 . . . . 0.0 109.898 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' MET . . . . . 0.588 ' SD ' ' HG3' ' B' ' 6' ' ' LYS . 4.8 tpp -112.75 24.14 12.75 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.066 -176.334 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . 0.75 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.05 -49.19 81.11 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.599 -0.728 . . . . 0.0 113.276 -177.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -31.91 68.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.064 0.459 . . . . 0.0 111.117 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.588 ' HG3' ' SD ' ' B' ' 3' ' ' MET . 15.0 mmtp -75.57 -57.99 3.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.406 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.75 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -79.23 -23.6 43.63 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.858 -0.737 . . . . 0.0 112.485 -174.489 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -53.82 -42.45 68.44 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.996 0.427 . . . . 0.0 110.536 -178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.44 -35.34 68.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.307 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.06 -47.53 68.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.458 0.171 . . . . 0.0 111.417 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' PHE . . . . . 0.526 ' CZ ' HD22 ' A' ' 70' ' ' LEU . 0.3 OUTLIER -57.23 -38.47 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.29 0.567 . . . . 0.0 110.317 179.563 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.1 OUTLIER -68.08 -27.06 66.16 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.371 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.91 -44.29 49.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -69.74 -50.59 41.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.29 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.55 HG13 ' HG2' ' A' ' 71' ' ' GLU . 0.9 OUTLIER -61.57 -33.27 56.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.304 -178.628 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -71.69 -33.73 69.06 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.423 179.485 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.54 64.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.122 0.486 . . . . 0.0 110.888 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.73 -32.84 70.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.061 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.39 -24.2 42.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.06 0.457 . . . . 0.0 111.024 173.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.38 -26.19 46.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.057 -176.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.557 ' O ' ' HD3' ' B' ' 103' ' ' ARG . 3.8 t0 -85.86 21.03 2.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.659 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.681 ' HE2' HG12 ' B' ' 110' ' ' ILE . 9.7 mtp -143.38 156.03 44.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.468 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 61.2 t -81.76 100.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' MET . . . . . 0.601 ' HE1' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -74.67 112.85 11.28 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.168 0.509 . . . . 0.0 111.111 -174.75 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . 0.493 HD21 ' HA ' ' B' ' 25' ' ' LEU . 2.5 mt -123.76 144.81 49.46 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.198 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 141.71 49.18 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.203 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -46.77 -24.17 2.86 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.404 3.403 . . . . 0.0 115.083 -174.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -74.43 -43.78 54.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.0 0.428 . . . . 0.0 110.626 177.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -72.65 -32.56 65.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.009 175.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.645 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -66.09 -52.2 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.778 178.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' TYR . . . . . 0.805 ' HA ' HD13 ' B' ' 34' ' ' LEU . 59.8 t80 -63.66 -29.87 71.05 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 122.221 -0.299 . . . . 0.0 111.063 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -52.75 63.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.056 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.517 ' HB2' HD11 ' B' ' 40' ' ' ILE . 0.2 OUTLIER -68.95 -26.51 65.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.259 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.805 HD13 ' HA ' ' B' ' 31' ' ' TYR . 46.8 mt -70.62 -49.69 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.023 0.439 . . . . 0.0 111.261 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -76.28 -24.65 54.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.233 -173.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.65 -34.19 15.53 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.129 -178.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.518 ' HB2' HG13 ' B' ' 40' ' ' ILE . 0.5 OUTLIER -126.64 102.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.563 -177.46 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -70.23 8.29 0.91 Allowed 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 123.327 2.685 . . . . 0.0 113.947 -176.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -92.33 -27.41 17.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.283 0.563 . . . . 0.0 109.588 173.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.926 HG12 ' HG2' ' B' ' 84' ' ' PRO . 2.8 mt -82.53 99.41 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.841 175.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.471 HG21 ' O ' ' B' ' 61' ' ' ASN . 0.2 OUTLIER -90.28 145.17 25.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.362 -176.096 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.552 ' HB2' HD23 ' B' ' 34' ' ' LEU . 2.5 tp -102.89 130.3 49.89 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.669 HG12 ' HE3' ' B' ' 65' ' ' MET . 94.4 mt -109.01 118.7 57.12 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.807 178.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.805 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -97.13 122.48 40.18 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.633 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.56 98.41 6.43 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 115.045 -0.98 . . . . 0.0 108.632 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . 0.631 ' HG3' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -161.41 169.89 21.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.993 -174.123 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.96 142.44 76.31 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 177.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -78.81 -19.23 11.22 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.683 2.255 . . . . 0.0 114.028 -174.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.41 -48.88 25.04 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 122.097 -0.377 . . . . 0.0 111.391 -176.002 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' GLU . . . . . 0.446 ' HG3' ' HB2' ' A' ' 49' ' ' ASP . 0.9 OUTLIER -67.74 -29.33 68.53 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 174.561 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -44.5 97.11 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.051 174.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -59.39 -38.68 81.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.98 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.61 -47.98 10.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.823 -171.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.71 -34.68 11.85 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -170.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.87 163.64 11.31 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.655 178.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.04 152.58 70.32 Favored Pre-proline 0 C--N 1.327 -0.4 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -58.39 122.79 12.27 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.521 2.147 . . . . 0.0 112.893 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -98.61 79.72 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.339 0.59 . . . . 0.0 110.272 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.599 HG23 ' HB2' ' B' ' 62' ' ' TYR . 1.2 m -113.43 162.78 11.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 178.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -41.33 88.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.315 -174.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.471 ' O ' HG21 ' B' ' 41' ' ' THR . 19.9 p30 -121.26 67.84 0.88 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.522 0.677 . . . . 0.0 111.208 -177.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' TYR . . . . . 0.805 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -105.52 125.32 50.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.808 176.736 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 3.7 mtmt -123.01 120.88 34.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.004 0.431 . . . . 0.0 110.617 176.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' HIS . . . . . 0.464 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 12.9 t-160 -87.22 113.69 23.18 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' MET . . . . . 0.905 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.1 OUTLIER -105.68 91.78 3.9 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.17 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -107.29 107.93 19.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.245 0.545 . . . . 0.0 112.212 -172.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' ARG . . . . . 0.691 ' HG2' ' HG2' ' B' ' 72' ' ' PRO . 1.1 tpt180 -144.47 -129.43 0.08 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 170.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . 0.49 ' HA3' HG23 ' A' ' 91' ' ' THR . . . -85.51 -44.22 6.24 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 119.242 -1.456 . . . . 0.0 109.768 169.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' LYS . . . . . 0.422 ' HA ' ' HE3' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -152.21 44.13 0.71 Allowed 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.19 -0.505 . . . . 0.0 110.288 173.575 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.775 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.0 OUTLIER 68.66 -6.16 0.88 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 173.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.634 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -44.79 -59.49 4.05 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -174.836 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . 0.691 ' HG2' ' HG2' ' B' ' 67' ' ' ARG . 11.9 Cg_exo -73.93 -17.38 22.52 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.453 2.102 . . . . 0.0 113.392 -176.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.905 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -91.11 -21.88 20.98 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.73 0.3 . . . . 0.0 110.636 -177.502 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.54 ' HB2' HD13 ' B' ' 70' ' ' LEU . 10.6 tp -62.34 -29.02 70.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.452 0.644 . . . . 0.0 110.885 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.603 ' HB3' ' HB2' ' A' ' 8' ' ' ASP . . . -77.22 -30.24 54.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.782 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.45 -7.18 32.19 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -171.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -27.02 57.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.807 0.337 . . . . 0.0 111.483 -176.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.15 51.23 2.45 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.306 -174.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 49.7 mt -109.46 142.79 39.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.914 0.387 . . . . 0.0 110.201 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.486 ' C ' ' H ' ' B' ' 82' ' ' GLU . 16.9 t70 -136.1 138.93 28.7 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.377 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 48.7 Cg_exo -60.95 16.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.631 2.887 . . . . 0.0 114.549 -175.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . 0.486 ' H ' ' C ' ' B' ' 80' ' ' ASP . 0.2 OUTLIER -107.68 -6.38 16.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 174.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 28.6 mttm -103.86 143.85 27.49 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.986 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.926 ' HG2' HG12 ' B' ' 40' ' ' ILE . 8.4 Cg_endo -83.12 141.01 10.19 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 C-N-CA 122.98 2.453 . . . . 0.0 111.108 174.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.534 HG22 HD13 ' B' ' 110' ' ' ILE . 0.0 OUTLIER -140.45 146.79 23.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.43 -178.324 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.405 ' HA ' ' O ' ' B' ' 111' ' ' TYR . 2.2 p -124.79 140.3 48.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . 0.669 ' HB ' ' HB3' ' B' ' 95' ' ' ALA . 4.2 m -107.23 125.51 63.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.656 -177.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.752 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 3.7 t80 -99.85 150.24 22.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.354 -178.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . 0.631 ' SG ' ' HG3' ' B' ' 46' ' ' ARG . 0.1 OUTLIER 75.26 67.68 0.08 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.459 0.647 . . . . 0.0 111.701 -179.376 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.499 ' HA ' ' H ' ' B' ' 95' ' ' ALA . 0.3 OUTLIER -84.15 -1.78 55.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.366 178.021 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' THR . . . . . 0.514 ' HB ' ' H ' ' B' ' 92' ' ' ALA . 0.0 OUTLIER -77.25 -109.09 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.956 -175.091 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.594 ' HA ' ' O ' ' A' ' 68' ' ' GLY . . . -63.9 -46.04 86.65 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -175.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.17 -27.73 64.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.835 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.99 71.02 0.55 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.85 177.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.669 ' HB3' ' HB ' ' B' ' 87' ' ' VAL . . . -65.22 -11.21 38.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.141 176.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.34 -32.69 66.98 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.145 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -71.35 -27.9 63.69 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.079 0.466 . . . . 0.0 110.81 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.47 -44.58 57.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.931 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 99' ' ' GLY . . . . . 0.61 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -87.05 -40.93 6.84 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.782 -174.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 100' ' ' LYS . . . . . 0.498 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -66.6 -29.54 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.004 0.402 . . . . 0.0 111.295 -174.883 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 101' ' ' THR . . . . . 0.455 ' HA ' ' HG3' ' B' ' 104' ' ' GLU . 8.0 m -72.74 -35.66 67.57 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.939 0.4 . . . . 0.0 111.127 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 102' ' ' LEU . . . . . 0.48 HD21 ' HA ' ' B' ' 102' ' ' LEU . 11.2 mt -66.61 -37.01 83.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 103' ' ' ARG . . . . . 0.557 ' HD3' ' O ' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -67.03 -25.07 66.09 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 179.194 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.455 ' HG3' ' HA ' ' B' ' 101' ' ' THR . 2.5 mt-10 -68.73 -6.6 27.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.23 174.696 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . 0.619 ' HH ' ' HA ' ' A' ' 11' ' ' PHE . 17.2 m-85 -110.18 -11.2 14.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.68 0.276 . . . . 0.0 110.744 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 97.75 60.47 0.93 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.349 -0.929 . . . . 0.0 113.2 174.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' PHE . . . . . 0.427 ' CE1' HD23 ' B' ' 102' ' ' LEU . 2.1 m-85 -92.46 158.16 16.18 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.745 -0.268 . . . . 0.0 110.291 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -61.26 -70.27 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.535 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.6 113.97 9.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 178.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' ILE . . . . . 0.681 HG12 ' HE2' ' B' ' 22' ' ' MET . 1.3 tt -113.06 123.5 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.625 0.726 . . . . 0.0 110.936 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' TYR . . . . . 0.405 ' O ' ' HA ' ' B' ' 86' ' ' VAL . 1.3 m-85 -113.99 146.81 39.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.271 -176.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.601 ' HB3' ' HE1' ' B' ' 24' ' ' MET . 24.3 t-20 -111.33 138.67 47.52 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.493 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 8.4 m -87.57 111.84 21.64 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.982 0.42 . . . . 0.0 112.038 -174.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . 0.407 ' HG2' ' SD ' ' B' ' 24' ' ' MET . 0.8 OUTLIER -63.21 148.28 48.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.253 177.081 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 85.38 -109.23 3.29 Favored Glycine 0 N--CA 1.442 -0.95 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.175 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . 0.588 ' HA3' ' S5 ' ' B' ' 139' ' ' PS5 . . . 162.57 -157.77 29.79 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 117' ' ' MET . . . . . 0.436 ' HB3' ' S3 ' ' B' ' 139' ' ' PS5 . 3.0 tmm? -60.6 -33.89 73.41 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.122 0.486 . . . . 0.0 110.144 177.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.579 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.52 -34.5 74.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.854 179.294 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 119' ' ' LYS . . . . . 0.403 ' O ' ' HB2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -72.74 -32.38 65.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.535 0.207 . . . . 0.0 111.384 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.752 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 20.2 t-105 -64.39 -54.63 29.78 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.84 -43.41 98.86 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.499 0.19 . . . . 0.0 111.163 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.579 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.6 OUTLIER -63.09 -33.08 74.69 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.898 -176.252 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . 0.582 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -82.96 -3.91 57.67 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.992 -177.28 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.18 27.75 73.6 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.672 -178.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.582 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 70.1 mt -72.47 161.97 76.36 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.273 . . . . 0.0 110.283 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . 0.575 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 21.8 Cg_endo -57.21 108.68 0.38 Allowed 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.851 2.367 . . . . 0.0 111.642 178.51 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.63 149.99 51.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 2.7 mt -103.15 101.2 11.15 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -135.36 143.61 46.19 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.868 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 130' ' ' ARG . . . . . 0.449 ' O ' ' HD2' ' B' ' 132' ' ' HIS . 8.0 ttt180 -91.84 103.15 15.73 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 179.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.61 125.95 18.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.715 -178.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 132' ' ' HIS . . . . . 0.449 ' HD2' ' O ' ' B' ' 130' ' ' ARG . 24.7 m170 -75.45 54.28 0.73 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.542 -175.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -88.82 60.62 5.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.129 0.49 . . . . 0.0 111.377 -177.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -151.87 29.75 0.59 Allowed 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.321 174.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.45 117.17 11.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.628 -178.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 49.0 p-80 -127.98 -5.01 5.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.249 0.547 . . . . 0.0 109.818 176.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 . . . . . 0 C--O 1.248 1.025 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.186 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' PS5 . . . . . 0.471 ' S5 ' ' HB ' ' A' ' 91' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 139' ' ' PS5 . . . . . 0.588 ' S5 ' ' HA3' ' B' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 120.652 0.263 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -83.8 45.1 1.04 Allowed 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -175.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.1 mmt -76.57 -13.71 60.06 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.655 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -52.16 -26.57 20.92 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 114.39 -1.277 . . . . 0.0 113.214 -179.195 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -33.27 57.62 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.541 ' HG3' ' N ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -61.29 -46.57 89.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.395 . . . . 0.0 112.001 -174.845 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.655 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 1.8 p90 -91.52 -20.51 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.821 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.51 -50.57 65.13 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 110.911 -177.882 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.71 -32.11 73.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.513 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -42.68 72.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.495 178.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.601 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.1 OUTLIER -56.82 -38.27 72.36 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.144 0.497 . . . . 0.0 110.152 176.435 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -32.17 73.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.652 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.32 -45.33 32.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.763 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -68.86 -51.45 40.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.657 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.487 HG13 ' CD ' ' B' ' 69' ' ' LYS . 22.3 t -61.97 -34.13 61.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.945 -176.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -58.7 -35.24 72.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.552 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -28.99 69.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 111.217 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.7 -31.75 61.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.622 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.532 ' HG3' ' SD ' ' A' ' 24' ' ' MET . 0.6 OUTLIER -76.9 -24.02 52.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.664 0.745 . . . . 0.0 110.119 173.74 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.9 -17.4 53.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.676 -178.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.571 ' HB3' ' HB2' ' A' ' 100' ' ' LYS . 0.4 OUTLIER -86.58 19.04 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -175.634 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.454 ' HB3' ' HE1' ' A' ' 22' ' ' MET . 0.1 OUTLIER -149.35 157.68 43.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.537 178.197 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -75.7 103.05 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.179 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.558 ' SD ' ' HG2' ' A' ' 114' ' ' GLU . 1.4 mmt -72.07 125.9 28.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.693 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -141.65 152.58 44.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.322 -178.033 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 139.8 37.13 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.774 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -50.46 -19.38 4.72 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.578 2.852 . . . . 0.0 113.982 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -46.01 51.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.848 0.356 . . . . 0.0 111.066 176.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.492 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 1.2 t70 -77.39 -29.32 53.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.971 0.415 . . . . 0.0 110.458 178.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.94 -36.25 77.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.43 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.483 ' HA ' HD11 ' A' ' 34' ' ' LEU . 60.6 t80 -74.38 -39.76 62.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.777 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.492 ' HG2' ' HA ' ' A' ' 29' ' ' ASP . 2.4 pttt -63.08 -41.08 99.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.98 -0.288 . . . . 0.0 111.592 -174.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.533 HD11 HG23 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -74.19 -26.19 60.13 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.764 0.316 . . . . 0.0 110.612 176.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.551 HD13 ' HB2' ' A' ' 42' ' ' LEU . 4.6 mt -61.16 -54.43 44.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.408 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -75.8 -28.32 58.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.547 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.519 ' HG2' ' HA ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -84.6 -22.65 29.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.825 0.345 . . . . 0.0 111.158 -176.166 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -121.05 106.83 38.37 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.209 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.468 ' HA ' HD22 ' A' ' 61' ' ' ASN . 14.0 Cg_exo -67.69 -0.94 5.89 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.817 2.345 . . . . 0.0 112.288 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.49 -25.33 15.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.066 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.62 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 53.6 mt -84.84 111.5 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.067 176.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.48 ' HA ' ' HB2' ' A' ' 61' ' ' ASN . 0.2 OUTLIER -106.71 144.91 32.68 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.967 -176.647 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.624 HD11 HG11 ' A' ' 86' ' ' VAL . 25.8 tp -101.94 125.97 48.74 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.46 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 4.1 mt -108.96 106.24 20.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.176 174.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.76 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 3.6 t0 -83.2 125.18 31.28 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . 0.473 ' CG2' ' HA ' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -110.31 97.19 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.603 0.716 . . . . 0.0 109.122 -178.731 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.557 HH11 ' HG2' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -162.51 -164.27 1.0 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.405 -176.0 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.47 ' CG ' HH12 ' B' ' 46' ' ' ARG . 11.7 m-20 -119.92 143.87 36.18 Favored Pre-proline 0 C--N 1.325 -0.472 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -177.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -65.68 -24.34 55.3 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 123.064 2.509 . . . . 0.0 114.194 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.82 -48.06 34.09 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.359 -176.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -27.35 64.56 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.137 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.516 HD22 ' HB3' ' A' ' 56' ' ' LYS . 0.3 OUTLIER -61.28 -43.3 99.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.943 173.253 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -59.97 -35.95 76.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.578 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.15 -37.31 23.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.336 -175.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.3 mmm -100.47 -34.4 9.95 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -173.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 119.19 169.01 14.2 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 121.138 -0.553 . . . . 0.0 112.059 -178.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.516 ' HB3' HD22 ' A' ' 51' ' ' LEU . 6.2 pttt -138.3 158.07 71.44 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.434 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 19.8 Cg_exo -68.2 133.87 29.86 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.315 2.01 . . . . 0.0 113.137 -176.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.624 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 21.3 t0 -97.13 86.42 3.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 176.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.579 HG21 ' HB2' ' A' ' 62' ' ' TYR . 6.5 m -133.28 159.66 42.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.307 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.928 -175.199 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.48 ' HB2' ' HA ' ' A' ' 41' ' ' THR . 0.4 OUTLIER -116.99 84.34 2.13 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.902 0.382 . . . . 0.0 110.737 -177.302 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.76 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 5.8 t80 -125.51 126.94 45.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.401 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.468 ' HD2' ' HB3' ' A' ' 77' ' ' SER . 8.5 mttm -127.34 126.88 43.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.231 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -96.59 120.96 37.86 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.503 0.192 . . . . 0.0 110.668 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.728 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -118.87 104.92 10.99 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 177.783 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -130.67 179.83 5.72 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -171.547 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.525 ' C ' ' H ' ' A' ' 69' ' ' LYS . 6.6 ttp180 60.38 -96.25 0.06 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.834 176.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.416 ' O ' ' HB2' ' A' ' 69' ' ' LYS . . . -55.46 17.13 0.01 OUTLIER Glycine 0 CA--C 1.526 0.744 0 N-CA-C 116.642 1.417 . . . . 0.0 116.642 -166.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.525 ' H ' ' C ' ' A' ' 67' ' ' ARG . 1.4 mtmp? 82.25 16.41 0.41 Allowed 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.852 0.861 . . . . 0.0 108.812 -175.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.728 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.1 OUTLIER 71.16 -26.52 0.17 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 113.947 -1.479 . . . . 0.0 112.483 -178.986 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.702 ' HG3' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -53.51 -42.76 93.58 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.455 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.702 ' HD3' ' HG3' ' A' ' 71' ' ' GLU . 9.7 Cg_exo -71.95 -18.06 28.13 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.573 1.516 . . . . 0.0 111.856 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.436 HD21 ' HA ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -97.6 -21.81 16.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.81 -176.746 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.579 HD23 HD22 ' A' ' 102' ' ' LEU . 15.3 tp -55.14 -56.63 17.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.971 -177.01 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.33 -19.91 64.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.039 -175.111 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -85.2 -12.26 53.07 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.468 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 20.3 m -105.42 35.9 2.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -173.098 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.04 56.98 5.0 Favored Glycine 0 C--N 1.335 0.474 0 O-C-N 123.365 0.415 . . . . 0.0 113.526 174.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.445 HD11 HD13 ' A' ' 74' ' ' LEU . 4.6 mt -109.19 140.98 42.09 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.769 0.319 . . . . 0.0 110.79 -178.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.55 154.64 76.89 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -68.74 2.67 2.79 Favored 'Trans proline' 0 CA--C 1.529 0.231 0 C-N-CA 122.802 2.335 . . . . 0.0 113.752 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.9 26.09 10.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.368 0.604 . . . . 0.0 110.176 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.8 mmtm -107.26 115.94 58.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -178.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.62 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 5.8 Cg_exo -74.06 103.75 1.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.574 2.182 . . . . 0.0 109.951 173.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.536 HG21 HG13 ' A' ' 110' ' ' ILE . 15.6 m -123.16 154.91 28.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.468 0.652 . . . . 0.0 111.79 -171.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.624 HG11 HD11 ' A' ' 42' ' ' LEU . 1.4 p -122.68 145.48 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.766 174.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.431 ' HA ' ' O ' ' A' ' 43' ' ' ILE . 5.2 m -110.1 129.78 64.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.67 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 5.2 t80 -104.87 133.66 49.3 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.176 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' CYS . . . . . 0.891 ' HB3' ' HB1' ' A' ' 95' ' ' ALA . 35.5 t 173.11 175.69 0.11 Allowed 'General case' 0 C--O 1.234 0.283 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 -177.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.792 ' HA ' ' HA2' ' A' ' 116' ' ' GLY . 0.0 OUTLIER -55.59 -61.4 2.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.938 0.399 . . . . 0.0 110.381 178.955 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.421 ' HB ' ' H ' ' A' ' 92' ' ' ALA . 0.0 OUTLIER -165.55 -101.37 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.299 176.26 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.719 ' HA ' ' HB1' ' A' ' 96' ' ' ALA . . . -95.93 27.42 3.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.132 0.491 . . . . 0.0 111.171 179.123 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.72 -54.06 8.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.487 179.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -136.99 -46.1 0.58 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.114 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.891 ' HB1' ' HB3' ' A' ' 89' ' ' CYS . . . -54.69 -35.8 63.98 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -174.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.719 ' HB1' ' HA ' ' A' ' 92' ' ' ALA . . . -57.1 -36.94 71.23 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.73 -35.33 77.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.525 0.202 . . . . 0.0 111.175 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.516 ' HB3' HD23 ' A' ' 70' ' ' LEU . . . -75.01 -53.44 8.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.124 0.488 . . . . 0.0 110.926 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.44 -53.97 25.77 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.719 -175.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.571 ' HB2' ' HB3' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -62.88 -37.33 86.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.682 0.277 . . . . 0.0 111.176 -173.192 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.515 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 11.0 m -72.43 -39.52 67.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.579 HD22 HD23 ' A' ' 74' ' ' LEU . 11.7 mt -64.83 -47.7 77.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.689 0.28 . . . . 0.0 111.422 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.789 ' HA ' ' HB2' ' A' ' 107' ' ' PHE . 1.7 ptm180 -63.6 -27.08 68.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.102 0.477 . . . . 0.0 110.734 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.73 -5.42 25.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.232 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -110.68 -6.64 14.78 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.197 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.56 31.62 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.919 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.789 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 2.3 m-85 -81.56 142.5 32.77 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.418 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.1 tttt -62.88 -87.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.445 -176.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.418 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -116.45 120.88 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.371 -177.2 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.536 HG13 HG21 ' A' ' 85' ' ' VAL . 0.5 OUTLIER -125.52 129.42 72.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -178.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -118.6 154.55 32.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.327 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.503 ' HB3' ' HE1' ' A' ' 24' ' ' MET . 39.5 t-20 -131.27 158.49 40.47 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -82.09 139.14 34.59 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.113 0.482 . . . . 0.0 111.478 -176.31 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.558 ' HG2' ' SD ' ' A' ' 24' ' ' MET . 0.0 OUTLIER -99.68 18.81 17.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 176.595 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.76 -75.73 0.16 Allowed Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.928 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.792 ' HA2' ' HA ' ' A' ' 90' ' ' LYS . . . 150.34 174.86 21.88 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.014 -0.613 . . . . 0.0 111.96 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' MET . . . . . 0.535 ' SD ' ' HD2' ' A' ' 46' ' ' ARG . 19.7 ttm -64.9 -36.37 84.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.419 0.628 . . . . 0.0 109.753 176.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -64.38 -27.78 69.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.044 177.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.407 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -69.37 -32.44 71.48 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 116.791 -0.186 . . . . 0.0 111.107 -179.165 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.67 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 27.8 t-105 -56.2 -52.29 64.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.3 mt -66.03 -40.86 91.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.444 178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -68.13 -43.07 79.17 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.725 -175.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 119' ' ' LYS . 65.1 mt-10 -69.69 -18.12 63.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.763 0.316 . . . . 0.0 110.816 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 93.65 25.04 19.21 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.488 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.2 mt -80.45 152.46 73.05 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.624 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 13.8 Cg_endo -56.32 120.89 9.06 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 123.154 2.569 . . . . 0.0 112.286 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.63 157.29 45.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.469 -177.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.447 ' HB2' ' HG3' ' A' ' 56' ' ' LYS . 2.9 mt -110.62 101.66 10.3 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.09 178.452 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -132.49 132.72 42.97 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.63 -50.38 0.62 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.195 0.598 . . . . 0.0 111.9 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.4 m 62.28 81.61 0.19 Allowed 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.215 0.606 . . . . 0.0 110.679 -179.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -64.35 -57.26 9.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.455 -177.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -166.2 127.23 1.77 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.008 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -110.72 -23.09 11.25 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.071 0.462 . . . . 0.0 110.148 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -136.46 146.03 45.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.016 177.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -109.76 -13.29 14.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.598 0.713 . . . . 0.0 109.405 177.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 117.645 -1.169 . . . . 0.0 108.327 -179.595 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.779 0.323 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -150.76 -36.23 0.14 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.989 0.423 . . . . 0.0 110.709 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.65 -3.07 55.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.918 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . 0.659 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -56.46 -27.07 53.25 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.469 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -74.61 -33.92 62.72 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.892 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.501 ' HG3' ' N ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -64.59 -47.05 80.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.872 -174.793 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.659 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 11.8 p90 -84.44 -24.26 29.6 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.38 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.85 -48.37 70.04 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.788 -178.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.23 -43.61 98.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.407 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -43.09 99.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.736 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' PHE . . . . . 0.673 ' CZ ' HD22 ' A' ' 70' ' ' LEU . 2.1 t80 -56.48 -41.24 76.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.292 0.568 . . . . 0.0 110.339 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' LYS . . . . . 0.63 ' HD2' ' HB2' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.87 -26.97 67.88 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.756 179.361 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.81 -40.57 61.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.075 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -71.28 -50.43 32.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.317 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -33.45 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.146 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.59 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -66.79 -40.19 88.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.794 0.33 . . . . 0.0 111.268 178.026 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.54 -26.32 68.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.447 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.8 71.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.6 -178.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -21.35 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.03 0.443 . . . . 0.0 111.092 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.0 -19.65 62.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.33 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -78.42 -9.26 59.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.953 0.406 . . . . 0.0 111.345 -178.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.529 ' HE3' HG23 ' B' ' 87' ' ' VAL . 11.8 mtp -116.93 165.7 13.03 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 122.212 -0.305 . . . . 0.0 110.998 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.53 111.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 174.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' MET . . . . . 0.645 ' HB3' ' HG3' ' B' ' 114' ' ' GLU . 0.7 OUTLIER -78.67 105.43 9.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.869 -175.109 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . 0.421 HD21 ' HA ' ' B' ' 25' ' ' LEU . 0.5 OUTLIER -121.78 148.26 44.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.505 0.669 . . . . 0.0 111.333 -177.039 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.99 137.05 33.37 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.207 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.467 ' HB2' HD13 ' B' ' 125' ' ' LEU . 4.4 Cg_exo -41.09 -31.65 0.86 Allowed 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 124.632 3.555 . . . . 0.0 115.388 -175.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.64 ' HG3' ' OE1' ' B' ' 123' ' ' GLU . 13.5 mtmm -73.43 -40.86 63.9 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.41 0.55 . . . . 0.0 110.738 178.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -69.66 -34.91 74.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.151 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.1 -43.27 78.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.362 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' TYR . . . . . 0.438 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 73.2 t80 -67.07 -31.09 71.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.327 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 tptt -61.58 -52.73 63.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.825 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.71 ' HB2' HD11 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -72.26 -26.62 62.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 179.755 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.584 HD13 ' HB2' ' B' ' 42' ' ' LEU . 5.1 mt -59.55 -55.39 35.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.0 mm100 -74.1 -32.88 63.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.174 -175.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.98 -40.67 68.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.259 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -108.5 113.61 59.93 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.371 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.45 -3.61 12.16 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 0.0 112.913 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -103.89 -16.64 15.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.538 -178.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.71 HD11 ' HB2' ' B' ' 33' ' ' LEU . 16.3 mt -81.12 109.02 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-O 121.25 0.548 . . . . 0.0 109.927 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.585 HG22 ' HG3' ' B' ' 63' ' ' LYS . 97.0 m -97.68 142.59 29.29 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.262 -176.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.584 ' HB2' HD13 ' B' ' 34' ' ' LEU . 11.3 tp -103.8 126.45 50.94 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 169.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.85 118.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.794 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -95.16 126.45 40.5 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.619 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.449 ' HA ' ' HG ' ' B' ' 66' ' ' SER . 0.7 OUTLIER -115.63 97.77 6.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.677 -178.231 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . 0.47 HH12 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -168.48 179.92 4.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.558 -177.738 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -98.68 154.79 37.3 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.237 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.28 -19.19 38.74 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.736 2.291 . . . . 0.0 113.452 -176.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -45.43 23.77 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.484 -178.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -30.63 63.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.67 -46.53 88.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.751 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.57 -31.83 71.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -85.06 -37.24 20.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' MET . . . . . 0.426 ' HE2' ' HB3' ' B' ' 117' ' ' MET . 5.5 mtm -98.93 -19.51 17.29 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -172.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 98.77 165.62 30.47 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.729 -175.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -143.58 145.01 29.71 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.452 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 13.8 Cg_endo -61.57 135.55 57.6 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.846 2.364 . . . . 0.0 112.724 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -112.32 84.24 1.94 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.378 178.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.425 HG22 HD23 ' B' ' 34' ' ' LEU . 3.5 m -121.69 167.22 15.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.381 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 mttm -60.43 -47.9 84.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -174.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.72 71.06 0.76 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.143 0.496 . . . . 0.0 110.906 -177.475 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' TYR . . . . . 0.794 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -114.92 131.59 56.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 177.239 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.588 ' HD2' ' HB3' ' B' ' 77' ' ' SER . 1.0 OUTLIER -133.8 126.84 31.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.261 0.553 . . . . 0.0 110.313 179.018 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -82.16 122.16 27.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.79 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' MET . . . . . 0.797 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.7 OUTLIER -139.79 100.43 3.95 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.223 -177.673 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' SER . . . . . 0.449 ' HG ' ' HA ' ' B' ' 45' ' ' VAL . 0.9 OUTLIER -149.98 -161.87 1.43 Allowed 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 121.162 -0.215 . . . . 0.0 111.481 -176.332 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' ARG . . . . . 0.614 ' C ' ' H ' ' B' ' 69' ' ' LYS . 0.2 OUTLIER 61.32 -95.74 0.05 Allowed 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.871 0.732 . . . . 0.0 111.464 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . 0.43 ' H ' ' HB3' ' B' ' 67' ' ' ARG . . . -57.86 18.31 0.02 OUTLIER Glycine 0 C--N 1.339 0.702 0 C-N-CA 123.937 0.779 . . . . 0.0 114.96 -171.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' LYS . . . . . 0.614 ' H ' ' C ' ' B' ' 67' ' ' ARG . 1.1 mtmp? 81.9 16.4 0.45 Allowed 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 124.367 1.067 . . . . 0.0 108.86 -174.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.591 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.3 OUTLIER 64.36 -26.54 0.08 Allowed 'General case' 0 C--N 1.346 0.455 0 C-N-CA 125.039 1.336 . . . . 0.0 113.365 175.986 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.517 ' H ' ' C ' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -50.2 -46.55 83.03 Favored Pre-proline 0 N--CA 1.474 0.755 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.483 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . 0.45 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 34.1 Cg_exo -61.24 -18.55 59.29 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.969 1.779 . . . . 0.0 112.454 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.797 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -105.68 -21.14 13.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 0.0 110.52 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.649 HD22 ' CD1' ' A' ' 7' ' ' PHE . 9.7 tp -64.36 -33.32 75.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.536 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.65 -24.29 45.27 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.81 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . 0.45 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 35.1 mtpt -86.69 -2.53 58.6 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -175.477 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' SER . . . . . 0.588 ' HB3' ' HD2' ' B' ' 63' ' ' LYS . 20.1 m -116.55 35.59 4.5 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 38.44 56.25 1.97 Allowed Glycine 0 C--N 1.338 0.661 0 O-C-N 123.626 0.579 . . . . 0.0 114.151 173.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.419 HD11 HD13 ' B' ' 74' ' ' LEU . 73.6 mt -103.25 140.04 37.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 0.0 110.542 -178.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.624 ' HB2' ' HG3' ' B' ' 83' ' ' LYS . 11.0 m-20 -126.06 140.71 37.59 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' PRO . . . . . 0.531 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 38.6 Cg_endo -66.16 6.34 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.812 2.342 . . . . 0.0 113.162 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . 0.404 ' H ' ' HG3' ' B' ' 82' ' ' GLU . 0.9 OUTLIER -105.87 -7.02 18.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.942 0.401 . . . . 0.0 110.727 176.55 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' LYS . . . . . 0.624 ' HG3' ' HB2' ' B' ' 80' ' ' ASP . 3.0 mttp -96.13 133.22 25.42 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.837 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.477 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.9 Cg_exo -72.56 123.04 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.645 2.23 . . . . 0.0 111.382 176.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.443 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 25.6 m -128.5 155.53 40.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.85 0.357 . . . . 0.0 110.717 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.523 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 1.4 p -129.99 144.04 39.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . 0.529 HG23 ' HE3' ' B' ' 22' ' ' MET . 12.0 m -105.83 129.31 59.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.895 0.378 . . . . 0.0 110.433 -179.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.771 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 3.3 t80 -105.84 130.04 53.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.666 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . 0.504 ' SG ' ' N ' ' B' ' 90' ' ' LYS . 0.0 OUTLIER 156.66 170.28 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 125.194 1.559 . . . . 0.0 107.087 -177.589 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.775 ' HB3' ' HB1' ' B' ' 93' ' ' ALA . 0.0 OUTLIER -61.36 121.79 13.53 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.375 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' THR . . . . . 0.583 HG23 ' HE2' ' B' ' 24' ' ' MET . 0.2 OUTLIER -11.93 -82.21 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -174.833 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.61 ' HA ' ' HB1' ' B' ' 96' ' ' ALA . . . -104.51 20.72 18.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.946 -175.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . 0.775 ' HB1' ' HB3' ' B' ' 90' ' ' LYS . . . -75.59 -36.77 60.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.844 0.354 . . . . 0.0 110.969 178.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.69 -29.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.675 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.11 -37.34 76.95 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.31 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' ALA . . . . . 0.61 ' HB1' ' HA ' ' B' ' 92' ' ' ALA . . . -59.01 -36.59 75.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.255 179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -68.22 -30.79 69.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.028 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' ALA . . . . . 0.495 ' HB3' HD23 ' B' ' 70' ' ' LEU . . . -76.68 -38.39 54.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.707 -176.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 99' ' ' GLY . . . . . 0.445 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -96.61 -41.85 3.52 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.939 -171.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -24.6 67.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.011 0.434 . . . . 0.0 110.867 -176.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.86 -53.94 11.66 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.574 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 32.2 mt -55.28 -44.6 75.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.797 -175.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 103' ' ' ARG . . . . . 0.609 ' HB3' HG23 ' B' ' 110' ' ' ILE . 0.0 OUTLIER -64.96 -31.17 72.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 110.811 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -75.52 -6.71 51.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.222 176.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . 0.601 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 16.5 m-30 -99.91 -11.36 20.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.953 0.406 . . . . 0.0 110.132 177.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.09 25.75 2.2 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.096 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' PHE . . . . . 0.576 ' HB2' ' HA ' ' B' ' 103' ' ' ARG . 2.3 m-85 -76.09 152.0 36.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 0.0 110.661 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -75.55 -77.7 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.335 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.39 109.31 13.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.005 0.431 . . . . 0.0 110.931 -178.199 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' ILE . . . . . 0.609 HG23 ' HB3' ' B' ' 103' ' ' ARG . 1.8 tt -114.57 129.68 70.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.587 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' TYR . . . . . 0.523 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 4.1 m-85 -113.37 143.72 44.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.056 -174.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.584 ' HB3' ' HE1' ' B' ' 24' ' ' MET . 19.5 t-20 -113.68 140.3 48.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 173.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.462 ' C ' ' H ' ' B' ' 115' ' ' GLY . 15.7 m -83.01 108.32 16.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.816 0.341 . . . . 0.0 111.634 -176.17 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . 0.645 ' HG3' ' HB3' ' B' ' 24' ' ' MET . 0.5 OUTLIER -71.99 30.16 0.05 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.645 -176.012 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . 0.538 ' HA3' ' HG2' ' B' ' 119' ' ' LYS . . . -145.1 -73.83 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.28 178.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 135.01 -177.63 19.17 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.675 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 117' ' ' MET . . . . . 0.426 ' HB3' ' HE2' ' B' ' 54' ' ' MET . 0.0 OUTLIER -60.89 -32.57 72.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.207 0.527 . . . . 0.0 110.812 179.316 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.458 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 30.0 p-10 -66.24 -28.85 69.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.936 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 119' ' ' LYS . . . . . 0.538 ' HG2' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -74.11 -33.21 63.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.301 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.771 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 19.3 t-105 -58.93 -49.91 76.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.913 0.387 . . . . 0.0 110.314 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.1 mt -68.67 -36.86 79.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.972 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.458 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.7 OUTLIER -68.32 -44.53 75.19 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . 0.64 ' OE1' ' HG3' ' B' ' 28' ' ' LYS . 68.1 mt-10 -80.1 8.61 6.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -176.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.58 21.36 77.28 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.245 172.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.467 HD13 ' HB2' ' B' ' 27' ' ' PRO . 96.0 mt -79.75 158.92 72.52 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-O 120.708 0.289 . . . . 0.0 111.001 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 41.5 Cg_endo -65.51 107.8 1.09 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.878 2.385 . . . . 0.0 112.326 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.84 150.39 46.46 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.86 100.75 4.89 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 178.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -135.81 92.79 2.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.881 -175.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.85 -88.8 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.321 -0.854 . . . . 0.0 112.428 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 131' ' ' SER . . . . . 0.415 ' HB2' ' H ' ' B' ' 132' ' ' HIS . 1.7 m 62.04 -108.55 0.3 Allowed 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.892 0.477 . . . . 0.0 110.516 -179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 132' ' ' HIS . . . . . 0.517 ' HB3' ' H ' ' B' ' 133' ' ' HIS . 0.1 OUTLIER -169.37 -104.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.795 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 133' ' ' HIS . . . . . 0.517 ' H ' ' HB3' ' B' ' 132' ' ' HIS . 0.8 OUTLIER -144.13 156.18 44.23 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 177.424 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -112.5 16.79 19.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.977 0.418 . . . . 0.0 110.272 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -132.99 90.57 2.77 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.087 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -92.64 40.18 1.05 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.328 0.585 . . . . 0.0 109.853 177.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 117.634 -1.174 . . . . 0.0 108.317 179.576 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 139' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.606 0.241 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -170.23 39.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.448 0.642 . . . . 0.0 109.909 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.407 ' HB2' ' HD2' ' B' ' 81' ' ' PRO . 1.4 mpp? -90.88 8.06 36.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.55 -177.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.763 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -59.65 -39.41 95.13 Favored Glycine 0 C--O 1.226 -0.395 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.748 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -39.47 91.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.045 0.45 . . . . 0.0 110.532 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.4 -55.78 29.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.106 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.921 ' HE2' ' HD3' ' B' ' 81' ' ' PRO . 3.0 p90 -78.97 -22.84 45.04 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.71 -176.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -54.31 -45.54 72.62 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.476 0.485 . . . . 0.0 110.613 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.05 91.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.945 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.413 ' HG1' ' HA ' ' A' ' 7' ' ' PHE . 0.3 OUTLIER -60.94 -41.72 96.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.069 -179.71 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -58.76 -45.73 89.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.072 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -66.04 -27.85 68.41 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.694 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.46 -39.78 62.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -72.66 -49.06 34.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.693 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.48 ' CG1' ' HG2' ' B' ' 71' ' ' GLU . 1.4 t -64.14 -34.08 66.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.605 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -67.3 -30.85 70.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.588 0.232 . . . . 0.0 111.085 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.84 -25.56 67.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.006 0.432 . . . . 0.0 110.904 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.6 -29.89 63.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.103 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.35 -23.35 50.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.196 0.522 . . . . 0.0 110.836 174.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.82 -19.9 36.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.976 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.19 -21.9 66.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.155 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.579 ' HG3' ' HB2' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -138.24 -174.88 3.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.996 0.427 . . . . 0.0 111.621 -177.527 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.7 t -87.22 112.95 23.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.08 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.48 114.1 19.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.44 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.429 HD21 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -121.61 143.08 49.52 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 -177.25 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -73.97 140.14 77.07 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.893 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -43.28 -36.27 6.11 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 124.232 3.288 . . . . 0.0 114.773 -175.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -41.26 61.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.927 0.394 . . . . 0.0 111.216 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -30.1 70.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.253 177.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.438 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.47 -45.69 52.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.604 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.68 ' HA ' HD13 ' A' ' 34' ' ' LEU . 60.4 t80 -63.38 -31.87 73.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.822 0.344 . . . . 0.0 111.097 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.476 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -56.87 -52.97 63.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.306 -178.649 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.441 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -70.4 -26.51 63.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.029 178.56 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.712 HD22 HG23 ' A' ' 40' ' ' ILE . 75.1 mt -64.34 -46.64 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.029 0.442 . . . . 0.0 111.008 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.705 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 1.2 pp0? -75.98 -29.51 58.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.572 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.63 -25.38 23.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -177.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -122.53 97.42 44.7 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.74 0.48 4.2 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.021 2.481 . . . . 0.0 112.818 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -95.43 -23.59 17.07 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.712 HG23 HD22 ' A' ' 34' ' ' LEU . 51.1 mt -80.07 112.38 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.172 173.015 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.476 HG21 ' HB2' ' A' ' 61' ' ' ASN . 0.2 OUTLIER -105.56 145.71 30.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.356 -174.192 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.575 HD11 HG12 ' A' ' 86' ' ' VAL . 4.3 tp -102.3 128.24 48.94 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.53 HD12 HD13 ' A' ' 79' ' ' LEU . 0.8 OUTLIER -108.55 117.09 53.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 175.574 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.821 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.9 OUTLIER -105.4 138.13 42.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.224 -175.226 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.67 98.59 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.074 175.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.656 ' HD3' ' HG3' ' A' ' 117' ' ' MET . 0.2 OUTLIER -144.62 147.63 33.34 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.331 -176.881 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 1.556 ' HB3' ' CG ' ' B' ' 47' ' ' ASP . 70.5 m-20 -62.21 136.11 95.34 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 123.392 0.432 . . . . 0.0 111.086 -177.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -61.6 -31.38 86.94 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.07 2.514 . . . . 0.0 113.1 -177.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -78.37 -36.6 45.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.815 ' HB2' ' HB2' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -67.94 -34.53 76.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.36 175.355 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.636 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 tp -57.9 -34.59 69.98 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.418 0.628 . . . . 0.0 110.315 176.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -75.74 -39.1 57.77 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.763 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.88 -48.25 11.77 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.454 ' O ' HD12 ' A' ' 121' ' ' LEU . 2.2 mtm -97.54 -36.61 10.25 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.595 -174.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.28 172.79 13.53 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.248 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.636 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -136.11 152.06 74.73 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.425 ' HD3' ' HE3' ' A' ' 117' ' ' MET . 11.8 Cg_endo -61.42 126.04 18.28 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.088 1.859 . . . . 0.0 112.769 -177.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.634 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 63.5 t0 -87.71 87.93 7.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.283 175.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.556 ' CG2' ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -123.27 144.91 31.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.79 179.354 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.705 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.69 -42.14 71.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.036 -176.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.476 ' HB2' HG21 ' A' ' 41' ' ' THR . 7.3 p30 -114.47 72.97 0.8 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.25 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.821 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 7.5 t80 -97.47 117.91 32.78 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.474 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.427 ' HB3' ' HE2' ' A' ' 65' ' ' MET . 6.4 mtmm -117.97 110.83 18.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.962 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -83.5 116.3 22.48 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.917 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -117.82 93.66 4.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.997 0.427 . . . . 0.0 110.989 -174.653 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.487 ' HB2' ' H ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -95.75 -109.82 0.14 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.87 -0.604 . . . . 0.0 112.184 -174.293 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.859 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.2 OUTLIER 56.56 -135.07 1.24 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -171.279 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -90.45 -41.31 5.48 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 119.763 -1.208 . . . . 0.0 111.169 175.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.446 ' HD2' ' HG3' ' B' ' 94' ' ' ARG . 0.5 OUTLIER -157.16 44.13 0.36 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.656 0.265 . . . . 0.0 110.899 176.673 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.917 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 68.19 -12.76 0.31 Allowed 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 172.594 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.574 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -45.38 -56.52 9.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.859 ' HG2' ' HG2' ' A' ' 67' ' ' ARG . 11.5 Cg_exo -72.92 -18.32 24.53 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.898 1.732 . . . . 0.0 113.026 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.697 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 1.0 OUTLIER -90.44 -16.42 29.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.042 0.449 . . . . 0.0 110.384 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.683 HD13 HD11 ' A' ' 79' ' ' LEU . 42.1 tp -68.11 -35.87 78.84 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.134 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.42 -31.21 53.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.329 175.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.617 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 3.0 mttm -70.08 -25.09 63.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.912 -176.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.92 -44.74 13.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.946 0.403 . . . . 0.0 110.634 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.52 58.0 0.97 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.776 -0.726 . . . . 0.0 111.598 -176.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.683 HD11 HD13 ' A' ' 74' ' ' LEU . 7.4 mt -91.6 145.02 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.604 0.24 . . . . 0.0 110.467 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -122.15 140.15 31.85 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -67.37 5.56 0.89 Allowed 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.881 2.388 . . . . 0.0 114.371 -173.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -101.85 -11.41 19.06 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.779 -0.575 . . . . 0.0 110.437 175.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.417 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.8 mptp? -87.9 119.96 70.66 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.257 -179.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.671 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 12.5 Cg_exo -67.68 133.46 29.74 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.683 2.255 . . . . 0.0 111.086 176.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 3.8 m -136.19 155.57 35.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.047 0.451 . . . . 0.0 111.213 -177.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.575 HG12 HD11 ' A' ' 42' ' ' LEU . 2.2 p -124.68 141.86 43.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.269 176.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.832 ' HB ' ' HB3' ' A' ' 95' ' ' ALA . 3.6 m -107.95 143.34 18.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.681 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 5.7 t80 -123.21 139.2 54.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -174.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 4.6 t 84.31 90.94 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.416 1.086 . . . . 0.0 111.974 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.559 ' HA ' ' H ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -101.44 -25.06 14.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.494 178.783 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.61 ' HA ' ' HA2' ' B' ' 68' ' ' GLY . 0.0 OUTLIER -87.73 36.69 0.77 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -174.009 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -167.61 -77.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.938 0.399 . . . . 0.0 110.386 176.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.07 -26.6 60.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.76 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.551 ' HB2' ' HE3' ' B' ' 69' ' ' LYS . 0.0 OUTLIER 75.89 77.93 0.1 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.227 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.832 ' HB3' ' HB ' ' A' ' 87' ' ' VAL . . . -58.13 -19.64 34.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.335 177.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.465 ' HB1' ' HD2' ' A' ' 94' ' ' ARG . . . -59.41 -34.64 72.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 177.792 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.21 -32.31 70.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.409 ' HB3' ' CD2' ' A' ' 70' ' ' LEU . . . -75.14 -38.14 61.13 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.644 -177.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.41 -44.8 3.64 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.704 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.403 ' O ' ' HG3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -61.5 -24.85 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.8 0.333 . . . . 0.0 110.854 -174.844 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.0 -50.75 26.1 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-O 121.359 0.599 . . . . 0.0 110.713 175.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.577 HD23 HD23 ' A' ' 74' ' ' LEU . 14.5 mt -55.05 -39.51 69.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.95 -173.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.421 HH11 ' HD3' ' A' ' 103' ' ' ARG . 0.7 OUTLIER -66.49 -27.65 67.96 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.849 -179.677 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 3.8 mt-10 -76.41 -7.78 55.76 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.024 0.44 . . . . 0.0 110.704 175.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.504 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 13.8 m-85 -103.65 -2.9 25.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.144 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 125.97 -12.15 7.28 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.232 -0.985 . . . . 0.0 113.685 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.598 ' HZ ' ' HB3' ' A' ' 79' ' ' LEU . 23.8 m-85 -59.44 111.8 1.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.082 0.467 . . . . 0.0 110.785 -177.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -66.97 -50.86 60.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.366 -171.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.671 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 1.8 m -121.54 101.99 7.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.195 0.522 . . . . 0.0 111.312 -174.675 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.523 HG21 ' O ' ' A' ' 110' ' ' ILE . 1.3 tt -121.15 130.9 74.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.922 -176.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -112.77 141.76 46.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.591 -176.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.579 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 19.6 t-20 -113.09 144.21 43.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.56 ' OG ' ' HA ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -79.86 130.42 35.3 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -171.055 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -174.71 1.55 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.196 171.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.853 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 45.76 -104.14 0.06 OUTLIER Glycine 0 CA--C 1.518 0.249 0 O-C-N 123.413 0.445 . . . . 0.0 113.576 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.455 ' HA3' ' S4 ' ' A' ' 138' ' ' PS5 . . . -177.46 -163.11 28.84 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 177.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' MET . . . . . 0.656 ' HG3' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -71.93 -29.39 64.24 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.142 0.496 . . . . 0.0 109.978 176.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -33.56 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.87 178.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.904 ' HA ' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -66.95 -32.05 73.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.612 -179.006 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.681 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -61.54 -54.66 40.25 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.454 HD12 ' O ' ' A' ' 54' ' ' MET . 16.6 mt -63.55 -42.83 98.36 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.92 0.391 . . . . 0.0 111.207 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.904 ' HG2' ' HA ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -70.45 -32.86 70.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.932 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.481 ' N ' ' HG3' ' A' ' 122' ' ' GLU . 19.0 mm-40 -80.65 3.4 22.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -178.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.41 25.05 76.13 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.214 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.472 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 60.5 mt -74.24 161.7 77.12 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.634 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 35.3 Cg_endo -61.03 115.32 2.63 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.516 2.144 . . . . 0.0 111.385 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.24 150.39 51.94 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.512 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 5.7 mt -102.92 102.3 12.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.059 0.457 . . . . 0.0 110.154 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.95 127.23 45.63 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.07 44.92 0.33 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.116 -172.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 m 50.12 89.83 0.02 OUTLIER 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.318 0.647 . . . . 0.0 112.232 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -77.72 72.24 4.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.709 175.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -123.57 -14.31 7.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.704 -173.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -94.17 88.4 5.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.08 0.466 . . . . 0.0 110.259 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.46 81.69 0.2 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.493 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -67.19 -30.95 71.03 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 174.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 . . . . . 0 C--O 1.251 1.142 0 CA-C-O 117.46 -1.257 . . . . 0.0 108.092 175.133 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 120.92 0.391 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -150.02 117.27 6.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.467 176.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' MET . . . . . 0.555 ' HG3' ' HB2' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -115.76 19.2 15.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.755 175.46 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . 0.747 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.24 -44.57 96.37 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.689 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.98 -32.34 72.68 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.165 0.507 . . . . 0.0 110.888 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.555 ' HB2' ' HG3' ' B' ' 3' ' ' MET . 0.4 OUTLIER -71.55 -52.52 17.73 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.438 -174.491 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.747 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -83.81 -22.85 31.67 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.219 -176.185 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -53.24 -45.72 68.87 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.154 0.502 . . . . 0.0 109.989 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.26 -39.42 90.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.527 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.63 -46.74 62.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.451 0.167 . . . . 0.0 111.269 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' PHE . . . . . 0.546 ' CZ ' HD22 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -56.67 -43.17 80.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.411 0.624 . . . . 0.0 109.947 179.227 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' LYS . . . . . 0.578 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.7 OUTLIER -66.2 -26.39 67.37 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.486 176.544 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.89 -49.35 20.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.892 0.377 . . . . 0.0 111.124 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -62.91 -50.97 68.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.129 179.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.475 HG11 ' N ' ' B' ' 16' ' ' LYS . 0.5 OUTLIER -66.41 -32.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.596 -175.251 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.578 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 6.3 ttmm -66.03 -40.76 91.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.583 0.23 . . . . 0.0 110.913 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.66 -27.01 62.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.485 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.85 -32.54 63.71 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.753 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -24.95 41.2 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.462 0.648 . . . . 0.0 110.702 172.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.04 -17.11 36.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.026 -0.988 . . . . 0.0 112.317 -175.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.559 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 8.4 t0 -69.05 -25.96 64.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.901 -174.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.613 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 5.8 ptm -119.73 176.68 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.847 0.356 . . . . 0.0 111.772 -176.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 41.2 t -74.17 111.97 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.916 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.1 109.36 15.59 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.854 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . 0.466 HD22 ' HA ' ' B' ' 25' ' ' LEU . 0.9 OUTLIER -119.52 146.04 45.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.317 0.58 . . . . 0.0 111.02 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.38 137.81 52.05 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.289 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -48.24 -22.35 3.78 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 124.05 3.167 . . . . 0.0 114.419 -176.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 16.7 mtmm -73.26 -42.47 62.46 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.165 -0.334 . . . . 0.0 110.906 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.26 -32.89 49.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.147 0.498 . . . . 0.0 110.225 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.48 -47.89 79.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.268 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' TYR . . . . . 0.637 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 78.8 t80 -66.82 -33.39 75.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 177.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.0 tptp -56.92 -50.22 73.23 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.115 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.654 ' HB2' HD11 ' B' ' 40' ' ' ILE . 0.2 OUTLIER -72.18 -26.3 62.01 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.727 177.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.417 HD11 ' HA ' ' B' ' 31' ' ' TYR . 18.4 mt -63.45 -51.04 67.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.858 0.361 . . . . 0.0 111.183 178.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.22 -31.25 67.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.395 -177.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -82.06 -38.29 25.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.822 0.344 . . . . 0.0 111.765 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -110.04 108.54 59.06 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.909 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.33 0.1 7.89 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.671 2.248 . . . . 0.0 111.759 176.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.22 -29.65 14.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.071 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.654 HD11 ' HB2' ' B' ' 33' ' ' LEU . 61.2 mt -82.63 109.43 16.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.948 177.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -102.23 143.57 31.85 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.798 -177.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.545 HD13 ' HB2' ' B' ' 88' ' ' PHE . 5.8 tp -100.19 127.9 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 174.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.81 HG12 ' HE2' ' B' ' 65' ' ' MET . 2.0 mt -109.13 118.3 56.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-O 121.235 0.54 . . . . 0.0 109.669 177.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.763 ' HB3' ' CE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -104.64 133.32 49.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.528 -0.76 . . . . 0.0 108.951 178.378 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.477 ' O ' HG21 ' B' ' 45' ' ' VAL . 27.6 m -131.61 99.52 3.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.034 -0.985 . . . . 0.0 109.974 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . 1.365 HH11 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -153.93 165.27 36.64 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.614 -1.175 . . . . 0.0 109.36 -176.668 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 1.556 ' CG ' ' HB3' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -66.51 129.86 94.13 Favored Pre-proline 0 C--N 1.316 -0.885 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.102 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . 0.474 ' O ' ' HB2' ' B' ' 52' ' ' LYS . 26.3 Cg_endo -68.72 -16.7 42.24 Favored 'Trans proline' 0 N--CA 1.474 0.349 0 C-N-CA 123.689 2.926 . . . . 0.0 114.843 -168.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.432 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . 0.4 OUTLIER -78.12 -46.62 20.19 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -173.531 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' GLU . . . . . 0.468 ' OE1' ' HE2' ' B' ' 117' ' ' MET . 1.2 tt0 -71.2 -33.53 70.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 0.0 110.365 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.53 -44.39 97.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.338 175.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' LYS . . . . . 0.474 ' HB2' ' O ' ' B' ' 48' ' ' PRO . 1.7 ttpt -63.69 -37.08 86.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.747 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -97.46 -44.85 6.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -171.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 1.9 mmm -90.28 -34.8 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.405 -0.518 . . . . 0.0 112.33 -171.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' GLY . . . . . 0.48 ' HA2' ' O ' ' B' ' 128' ' ' LEU . . . 149.72 145.05 4.05 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.077 -1.059 . . . . 0.0 113.764 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' LYS . . . . . 0.415 ' HG3' ' HB2' ' B' ' 128' ' ' LEU . 0.0 OUTLIER -133.9 165.07 39.48 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 174.67 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.11 129.37 17.11 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.576 1.518 . . . . 0.0 112.559 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . 0.598 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 13.4 t70 -90.37 95.33 10.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.447 ' CG2' ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -138.27 153.14 26.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.598 -174.191 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.404 ' HB2' ' HE3' ' B' ' 60' ' ' LYS . 0.0 OUTLIER -71.09 -34.24 70.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.312 -176.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -132.53 79.39 1.85 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.31 0.576 . . . . 0.0 111.867 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' TYR . . . . . 0.763 ' CE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -139.08 137.62 36.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.482 176.287 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -120.7 129.09 53.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.944 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -90.29 111.74 23.04 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' MET . . . . . 0.81 ' HE2' HG12 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -98.84 91.83 5.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.541 0.21 . . . . 0.0 110.516 -176.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.77 120.57 38.39 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.992 0.425 . . . . 0.0 111.543 -175.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' ARG . . . . . 0.498 ' HG2' ' CG ' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -155.55 -141.62 0.1 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 173.376 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . 0.61 ' HA2' ' HA ' ' A' ' 91' ' ' THR . . . -80.98 -42.26 9.75 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 119.322 -1.418 . . . . 0.0 109.641 169.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' LYS . . . . . 0.551 ' HE3' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -152.32 43.17 0.68 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.336 -0.932 . . . . 0.0 108.694 171.773 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.51 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.4 OUTLIER 55.76 2.95 0.08 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.165 1.386 . . . . 0.0 114.523 178.456 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.566 ' HB2' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -45.41 -63.97 1.05 Allowed Pre-proline 0 CA--C 1.547 0.837 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -174.417 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . 0.566 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 61.8 Cg_endo -75.24 -12.78 21.05 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.349 2.033 . . . . 0.0 113.561 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.516 ' HB3' ' HG2' ' B' ' 65' ' ' MET . 0.1 OUTLIER -89.5 2.73 54.18 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.318 -0.239 . . . . 0.0 111.169 -174.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.611 HD22 ' CD1' ' A' ' 7' ' ' PHE . 8.7 tp -72.74 -52.86 13.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.344 -177.352 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -72.13 -19.68 61.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.733 0.302 . . . . 0.0 111.498 -177.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.65 -27.57 31.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.648 -175.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -77.95 -27.12 49.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -177.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.24 75.38 1.3 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.511 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 9.5 mt -129.59 145.23 51.5 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -128.03 138.47 33.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' PRO . . . . . 0.921 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 35.6 Cg_endo -69.21 12.48 0.28 Allowed 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.209 2.606 . . . . 0.0 114.245 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -102.77 -12.11 17.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 176.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -95.5 133.91 25.09 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.279 -177.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.561 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.7 Cg_exo -71.65 126.8 12.42 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.429 2.086 . . . . 0.0 110.839 175.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.444 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 6.3 m -132.11 151.88 35.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.534 -176.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.533 HG11 HD11 ' B' ' 42' ' ' LEU . 1.6 p -125.62 141.78 44.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . 0.844 ' HB ' ' HB2' ' B' ' 95' ' ' ALA . 16.6 m -107.73 141.03 23.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.929 ' HZ ' ' HB2' ' B' ' 120' ' ' TRP . 8.9 t80 -119.12 141.48 48.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.034 -173.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . 0.576 ' HB2' ' O ' ' B' ' 88' ' ' PHE . 1.4 m 81.36 75.98 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.618 0.767 . . . . 0.0 111.754 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.554 ' HE3' ' HA ' ' B' ' 114' ' ' GLU . 0.0 OUTLIER -95.19 -23.66 17.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.191 -177.944 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' THR . . . . . 0.401 ' HB ' ' S4 ' ' B' ' 139' ' ' PS5 . 0.1 OUTLIER -100.87 35.93 2.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -175.285 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.413 ' HB2' ' H ' ' B' ' 93' ' ' ALA . . . -146.23 -88.67 0.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.318 176.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' B' ' 94' ' ' ARG . . . -74.64 -24.52 58.84 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.844 174.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' B' ' 93' ' ' ALA . 12.1 mmt180 80.72 83.8 0.04 OUTLIER 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.802 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.844 ' HB2' ' HB ' ' B' ' 87' ' ' VAL . . . -66.89 -10.57 50.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.151 -0.932 . . . . 0.0 110.625 175.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.52 -33.58 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.69 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.07 -29.75 70.14 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.602 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' ALA . . . . . 0.657 ' HB2' HG13 ' B' ' 87' ' ' VAL . . . -75.88 -56.04 5.05 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.293 0.568 . . . . 0.0 110.685 176.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 99' ' ' GLY . . . . . 0.637 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -71.74 -48.63 27.32 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.023 -0.99 . . . . 0.0 114.464 -171.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 100' ' ' LYS . . . . . 0.559 ' HB2' ' HB3' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -68.41 -33.71 74.72 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.497 -0.413 . . . . 0.0 111.107 -174.154 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 6.2 m -72.07 -36.01 69.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.656 0.265 . . . . 0.0 110.889 176.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 102' ' ' LEU . . . . . 0.579 HD21 ' CE1' ' B' ' 107' ' ' PHE . 8.9 mt -64.18 -47.75 78.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.446 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 103' ' ' ARG . . . . . 0.716 ' HB3' HG23 ' B' ' 110' ' ' ILE . 0.6 OUTLIER -65.1 -26.99 68.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.791 0.329 . . . . 0.0 110.597 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 2.9 mt-10 -73.11 -6.79 48.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.33 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 22.0 m-30 -106.07 -8.37 17.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.961 0.41 . . . . 0.0 110.284 175.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 109.28 60.92 0.52 Allowed Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.49 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' PHE . . . . . 0.579 ' CE1' HD21 ' B' ' 102' ' ' LEU . 1.3 m-85 -104.48 139.61 39.15 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 176.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 -77.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.498 0.499 . . . . 0.0 111.522 -175.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.5 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 2.7 m -129.94 109.05 10.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.141 0.495 . . . . 0.0 111.238 -178.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' ILE . . . . . 0.716 HG23 ' HB3' ' B' ' 103' ' ' ARG . 2.3 tt -115.77 130.33 70.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.672 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -114.6 146.85 40.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.45 -177.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.613 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 7.0 t-20 -111.27 138.4 47.79 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 172.098 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.505 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 65.5 m -87.83 112.64 22.68 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . 0.554 ' HA ' ' HE3' ' B' ' 90' ' ' LYS . 5.5 tp10 -62.06 145.76 52.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.966 176.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.75 -110.6 3.32 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.434 -0.889 . . . . 0.0 111.624 -174.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . 0.512 ' HA3' ' S3 ' ' B' ' 139' ' ' PS5 . . . 160.37 -162.5 33.35 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 117' ' ' MET . . . . . 0.468 ' HE2' ' OE1' ' B' ' 50' ' ' GLU . 0.2 OUTLIER -58.88 -36.19 74.24 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.011 0.434 . . . . 0.0 110.699 179.401 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.591 ' HB3' ' S5 ' ' B' ' 139' ' ' PS5 . 3.5 t70 -61.85 -35.06 77.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.406 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 119' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -74.01 -33.42 63.78 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.806 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.929 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 25.9 t-105 -57.6 -52.96 63.28 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.59 -39.84 95.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.024 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.46 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -70.67 -35.15 72.7 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 112.341 0.496 . . . . 0.0 112.341 -174.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 19.1 mm-40 -74.83 -4.24 36.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.813 0.34 . . . . 0.0 110.519 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.07 23.85 73.23 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.705 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.494 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 72.4 mt -76.67 160.78 76.25 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . 0.494 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 29.5 Cg_endo -61.39 108.26 0.58 Allowed 'Trans proline' 0 C--O 1.236 0.397 0 C-N-CA 122.35 2.033 . . . . 0.0 111.221 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.71 156.01 43.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.714 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 128' ' ' LEU . . . . . 0.598 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 8.4 mt -110.55 100.66 9.43 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.897 0.38 . . . . 0.0 110.398 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -102.37 143.09 32.56 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 173.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.05 92.42 7.87 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 118.586 0.63 . . . . 0.0 109.319 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -38.47 112.4 0.23 Allowed 'General case' 0 C--N 1.33 -0.275 0 O-C-N 124.321 1.013 . . . . 0.0 112.474 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -113.62 87.71 2.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.14 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -98.41 -10.01 24.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.773 -178.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -72.91 -32.88 65.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.961 0.41 . . . . 0.0 110.179 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -76.39 68.31 2.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.29 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -79.87 -6.05 56.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.397 0.618 . . . . 0.0 109.543 175.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 . . . . . 0 C--O 1.248 1.012 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 171.715 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' PS5 . . . . . 0.455 ' S4 ' ' HA3' ' A' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 139' ' ' PS5 . . . . . 0.591 ' S5 ' ' HB3' ' B' ' 118' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -96.04 166.86 11.56 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 177.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -99.5 7.5 45.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.827 0.346 . . . . 0.0 111.304 -175.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.649 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -49.98 -23.45 5.48 Favored Glycine 0 CA--C 1.522 0.493 0 CA-C-N 115.127 -0.942 . . . . 0.0 114.061 -174.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -73.78 -32.68 63.9 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -64.07 -47.38 80.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -173.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.649 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.3 p90 -91.1 -23.19 20.38 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.967 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.41 ' HB2' ' HB3' ' B' ' 75' ' ' ALA . 2.9 t70 -53.59 -54.92 30.69 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.852 0.358 . . . . 0.0 110.629 -178.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.96 -42.24 89.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.526 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.506 ' HB ' ' CZ ' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -68.91 -44.98 72.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.41 -178.505 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.55 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.6 OUTLIER -57.93 -47.41 82.94 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.253 0.549 . . . . 0.0 110.074 -179.377 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.499 ' HD2' ' HD2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -64.76 -26.29 68.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.107 177.127 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.13 -40.78 64.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.883 0.373 . . . . 0.0 111.392 178.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -72.36 -49.88 30.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.793 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.485 HG23 HH22 ' B' ' 94' ' ' ARG . 3.0 t -62.07 -36.47 74.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.303 -176.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.499 ' HD2' ' HD2' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -64.14 -30.05 71.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.566 0.222 . . . . 0.0 111.49 179.558 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.02 68.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 110.687 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.62 -30.13 62.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.397 177.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.721 ' HG2' ' HE2' ' A' ' 24' ' ' MET . 13.5 mtpp -77.02 -24.15 52.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.528 0.68 . . . . 0.0 110.302 172.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.86 35.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.981 -1.008 . . . . 0.0 111.234 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -71.03 -24.21 62.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.787 -175.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.749 ' HE2' HG12 ' A' ' 110' ' ' ILE . 14.5 mtp -121.23 178.47 4.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.691 0.282 . . . . 0.0 111.158 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.7 112.45 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.541 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.721 ' HE2' ' HG2' ' A' ' 19' ' ' LYS . 0.9 OUTLIER -78.28 103.19 8.06 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.174 -176.891 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.433 HD21 ' HA ' ' A' ' 25' ' ' LEU . 3.2 mt -112.08 139.62 47.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.979 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.39 147.77 57.35 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.897 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.532 ' HB3' ' CE3' ' A' ' 120' ' ' TRP . 26.9 Cg_exo -34.18 -56.42 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.536 3.49 . . . . 0.0 114.394 -175.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.594 ' HG3' ' OE1' ' A' ' 123' ' ' GLU . 4.4 mttp -63.37 -37.82 88.76 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.51 -34.91 76.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 0.0 110.343 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.612 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -71.79 -47.37 53.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.518 176.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.577 ' HA ' HD11 ' A' ' 34' ' ' LEU . 82.6 t80 -60.02 -32.25 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.351 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.73 -51.87 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.494 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -74.31 -27.16 60.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.033 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.638 HD23 ' HB2' ' A' ' 42' ' ' LEU . 81.6 mt -62.98 -55.35 26.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.989 0.423 . . . . 0.0 111.263 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.662 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -75.85 -22.27 56.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.071 -173.601 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.402 ' HG2' ' ND2' ' A' ' 37' ' ' ASN . 0.3 OUTLIER -93.72 -24.29 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.883 0.373 . . . . 0.0 110.791 -177.15 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.409 ' C ' ' H ' ' A' ' 39' ' ' ASP . 0.8 OUTLIER -129.49 94.11 33.54 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.288 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -68.81 9.58 0.44 Allowed 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.73 2.287 . . . . 0.0 113.103 -179.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.409 ' H ' ' C ' ' A' ' 37' ' ' ASN . 0.2 OUTLIER -91.12 -29.17 17.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.763 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.618 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 26.2 mt -83.16 100.91 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.458 173.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.408 ' O ' ' HA ' ' A' ' 85' ' ' VAL . 9.9 m -92.61 146.8 23.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.401 -175.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.638 ' HB2' HD23 ' A' ' 34' ' ' LEU . 8.3 tp -100.74 128.3 46.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 173.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.1 mt -109.59 118.15 56.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.442 177.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.836 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -102.39 124.02 47.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.225 0.536 . . . . 0.0 109.869 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -109.26 96.68 4.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.429 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.687 ' NE ' ' HA ' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -150.06 163.33 38.45 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.294 -176.32 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.557 ' HB3' ' HB2' ' A' ' 50' ' ' GLU . 6.0 t70 -75.91 137.28 69.6 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.786 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -59.6 -29.95 91.13 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.677 2.251 . . . . 0.0 112.367 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.23 -36.23 47.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.809 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.557 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -65.88 -35.79 81.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 173.251 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.841 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.0 OUTLIER -65.51 -33.67 76.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.734 177.232 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -42.08 61.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.648 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.06 -45.55 23.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -175.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.1 mtp -101.41 -34.7 9.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 116.41 179.14 18.05 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.56 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.841 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -148.23 155.7 43.09 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.108 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.47 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 23.4 Cg_endo -65.52 137.51 50.91 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.413 2.076 . . . . 0.0 112.598 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.685 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t0 -111.95 84.72 2.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.229 0.537 . . . . 0.0 110.595 178.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.547 HG23 ' HB2' ' A' ' 62' ' ' TYR . 13.0 m -112.02 163.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.005 176.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.662 ' HD2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.83 -42.94 72.53 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.634 0.584 . . . . 0.0 111.59 -177.546 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -120.47 76.76 1.21 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.724 0.773 . . . . 0.0 111.206 -178.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.836 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 2.4 t80 -116.99 125.97 52.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.431 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 6.3 mttm -122.02 123.53 41.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.124 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.433 ' HB2' ' OH ' ' A' ' 62' ' ' TYR . 11.4 t-160 -94.64 132.93 38.85 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.609 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -107.42 150.84 26.3 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.66 178.174 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.438 ' HB2' ' HB3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -80.65 50.46 1.33 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -173.147 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.545 ' HD3' ' HA ' ' A' ' 47' ' ' ASP . 11.6 mtm180 61.2 -79.44 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 171.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -100.72 -3.44 55.05 Favored Glycine 0 CA--C 1.501 -0.842 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.492 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.3 OUTLIER -116.12 29.34 8.03 Favored 'General case' 0 N--CA 1.436 -1.125 0 CA-C-N 114.22 -0.99 . . . . 0.0 108.944 177.586 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.618 HD22 ' CZ ' ' B' ' 11' ' ' PHE . 0.0 OUTLIER -66.51 -43.57 84.9 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 174.384 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.849 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.8 mp0 -49.05 -60.1 5.28 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.708 -177.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.849 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 13.8 Cg_exo -71.26 -18.09 30.54 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.248 1.966 . . . . 0.0 113.124 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.495 HD21 ' HA ' ' A' ' 73' ' ' LEU . 0.2 OUTLIER -88.69 -15.45 34.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.616 0.246 . . . . 0.0 111.414 -178.434 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.454 HD12 HD13 ' A' ' 70' ' ' LEU . 3.3 tp -57.88 -52.8 63.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.239 0.543 . . . . 0.0 110.507 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' B' ' 4' ' ' GLY . . . -68.14 -29.4 68.29 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.651 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.509 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 1.6 mtpt -75.69 -30.39 59.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.072 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.9 m -78.85 -38.01 38.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.92 90.5 2.13 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.389 177.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.3 mt -134.23 148.54 50.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.848 0.356 . . . . 0.0 111.084 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.444 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -134.45 138.25 29.67 Favored Pre-proline 0 C--N 1.328 -0.331 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.358 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.508 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 44.4 Cg_exo -63.88 -1.06 3.07 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.368 2.712 . . . . 0.0 114.608 -172.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -97.1 -5.88 36.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.039 0.447 . . . . 0.0 110.15 175.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -92.82 116.0 65.8 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.295 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.618 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 17.1 Cg_exo -63.27 141.44 82.1 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.436 2.09 . . . . 0.0 110.411 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.649 HG22 HD13 ' A' ' 110' ' ' ILE . 0.5 OUTLIER -138.58 146.28 26.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 121.091 0.472 . . . . 0.0 111.384 -175.246 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.507 HG21 ' N ' ' A' ' 87' ' ' VAL . 1.5 p -119.91 142.9 33.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 172.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.507 ' N ' HG21 ' A' ' 86' ' ' VAL . 5.3 m -102.85 127.43 56.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.038 0.447 . . . . 0.0 110.732 -177.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.573 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 3.7 t80 -113.47 151.95 30.78 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.5 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' CYS . . . . . 0.463 ' SG ' ' HB1' ' A' ' 95' ' ' ALA . 5.4 p 179.36 -169.68 0.11 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.526 -176.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.453 ' HD2' ' HB3' ' A' ' 118' ' ' ASP . 0.3 OUTLIER -141.71 56.2 1.5 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.528 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.439 ' O ' ' HB1' ' A' ' 92' ' ' ALA . 0.7 OUTLIER -175.87 -21.0 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.707 -174.35 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.577 ' HA ' ' S2 ' ' A' ' 138' ' ' PS5 . . . 74.53 -43.88 0.54 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.862 0.865 . . . . 0.0 112.618 177.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.411 ' HB3' ' CZ ' ' B' ' 94' ' ' ARG . . . -55.07 -54.3 44.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.086 0.772 . . . . 0.0 113.086 -173.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.47 -22.9 56.89 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.93 -176.424 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.463 ' HB1' ' SG ' ' A' ' 89' ' ' CYS . . . -67.24 -53.72 27.54 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 174.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.28 -36.75 76.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.132 176.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -67.17 -36.8 82.56 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.824 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.628 ' HA ' ' HZ ' ' B' ' 11' ' ' PHE . . . -74.47 -47.96 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.46 . . . . 0.0 110.644 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.584 ' HA2' HD12 ' A' ' 110' ' ' ILE . . . -69.77 -52.99 17.38 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.666 -0.697 . . . . 0.0 113.626 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.564 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.39 -30.7 71.79 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.66 -0.318 . . . . 0.0 111.372 -175.21 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.453 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 47.3 m -73.05 -37.95 66.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.362 . . . . 0.0 110.846 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.437 HD21 ' HA ' ' A' ' 102' ' ' LEU . 12.8 mt -64.2 -46.11 85.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.153 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.37 -26.49 68.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 110.349 177.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -72.98 -9.21 58.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.491 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.42 ' HH ' ' C ' ' B' ' 10' ' ' THR . 20.9 m-85 -106.03 -18.46 14.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 0.0 110.6 177.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 117.04 54.95 0.31 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.875 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -94.47 167.92 11.2 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.711 -0.287 . . . . 0.0 110.261 176.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.528 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.4 tttt -77.17 -98.37 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.83 0.348 . . . . 0.0 111.303 -176.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.528 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -107.04 121.71 45.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.524 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.749 HG12 ' HE2' ' A' ' 22' ' ' MET . 1.0 OUTLIER -121.91 126.77 74.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.49 0.662 . . . . 0.0 111.477 -174.775 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.47 147.53 44.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.254 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.636 ' HB3' ' HE1' ' A' ' 24' ' ' MET . 12.9 t-20 -117.71 144.78 44.94 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.5 131.3 36.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.473 0.654 . . . . 0.0 111.348 -172.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 114' ' ' GLU . 3.8 tp10 -98.2 3.8 48.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.511 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.82 -92.9 2.28 Favored Glycine 0 N--CA 1.443 -0.84 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.203 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.41 ' HA2' ' O ' ' A' ' 89' ' ' CYS . . . 141.32 161.44 8.71 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' MET . . . . . 0.545 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -56.97 -41.38 78.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.115 0.457 . . . . 0.0 110.954 -176.97 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.453 ' HB3' ' HD2' ' A' ' 90' ' ' LYS . 9.5 p-10 -69.37 -27.61 65.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.424 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.445 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -72.65 -32.49 65.9 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.761 176.629 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.573 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 41.5 t-105 -56.99 -47.28 81.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.378 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.44 -38.22 86.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.753 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 119' ' ' LYS . 64.6 mt-10 -65.67 -37.3 86.12 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.558 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.594 ' OE1' ' HG3' ' A' ' 28' ' ' LYS . 15.5 mt-10 -83.58 4.08 29.81 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 70.48 28.8 70.61 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.344 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 125' ' ' LEU . 71.7 mt -85.83 158.88 55.84 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-O 120.516 0.198 . . . . 0.0 110.513 -178.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 19.7 Cg_endo -57.25 119.06 6.06 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.415 2.743 . . . . 0.0 112.564 -177.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.4 m -133.19 158.31 43.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.032 0.444 . . . . 0.0 111.459 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.685 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 1.1 mt -113.97 111.31 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.295 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -142.47 150.76 40.96 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -86.64 70.59 10.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.99 0.424 . . . . 0.0 110.69 -177.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.06 -25.77 66.41 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.572 177.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.77 112.36 24.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.557 177.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -92.84 68.11 4.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.891 178.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -77.18 113.18 14.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.495 -175.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -156.8 116.98 3.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.955 176.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -113.06 158.33 20.47 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.491 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 1.4 t60 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.421 177.984 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.11 148.24 34.38 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' MET . . . . . 0.508 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mmm -90.03 3.65 52.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.469 -173.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . 0.691 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.45 -36.26 76.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.474 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.67 -32.29 73.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.857 0.361 . . . . 0.0 111.027 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -63.51 -48.12 78.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.994 -176.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.691 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.7 p90 -90.62 -22.46 21.2 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.192 -177.296 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . 0.404 ' HB2' ' HB3' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -53.67 -47.43 70.41 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.986 0.422 . . . . 0.0 110.756 -177.153 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.9 -43.6 98.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.107 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' THR . . . . . 0.42 ' C ' ' HH ' ' A' ' 105' ' ' TYR . 0.2 OUTLIER -65.45 -42.57 92.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.522 -178.825 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' PHE . . . . . 0.628 ' HZ ' ' HA ' ' A' ' 98' ' ' ALA . 0.2 OUTLIER -55.59 -50.41 70.16 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.006 0.431 . . . . 0.0 111.107 -176.797 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' LYS . . . . . 0.45 ' HD2' ' HA ' ' B' ' 12' ' ' LYS . 20.9 tptt -69.68 -23.66 63.48 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.191 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.71 75.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -71.43 -50.14 34.78 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.229 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.73 -34.59 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.242 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -63.07 -31.97 73.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.529 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.32 -26.21 64.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 0.0 111.193 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.27 -45.6 83.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.702 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.521 ' HB2' ' HE2' ' B' ' 24' ' ' MET . 1.1 ptmt -75.3 -21.01 58.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.099 0.476 . . . . 0.0 111.067 176.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -17.14 60.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.543 -178.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.4 -19.73 60.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.92 0.391 . . . . 0.0 111.554 -177.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.712 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 2.6 ptm -120.86 -179.54 4.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.758 0.313 . . . . 0.0 110.916 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.34 106.71 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.109 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' MET . . . . . 0.521 ' HE2' ' HB2' ' B' ' 19' ' ' LYS . 0.1 OUTLIER -74.41 103.56 4.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.186 0.517 . . . . 0.0 110.267 178.72 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 1.5 mt -116.0 141.35 48.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.885 -178.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.45 144.37 43.09 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.374 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.525 ' HB2' HD13 ' B' ' 125' ' ' LEU . 3.9 Cg_exo -40.68 -34.13 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 124.814 3.676 . . . . 0.0 115.402 -174.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.517 ' HE3' ' HB3' ' B' ' 123' ' ' GLU . 1.5 mttt -74.47 -44.04 53.38 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.672 0.669 . . . . 0.0 111.266 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.24 -33.38 75.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.247 0.546 . . . . 0.0 110.15 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.79 52.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.821 177.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' TYR . . . . . 0.54 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.6 t80 -63.96 -32.9 74.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.522 0.201 . . . . 0.0 111.037 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.417 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -54.59 -53.73 50.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.898 -179.741 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.619 ' HB2' HD11 ' B' ' 40' ' ' ILE . 0.2 OUTLIER -74.78 -27.69 60.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.156 179.086 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.54 ' HB2' ' HA ' ' B' ' 31' ' ' TYR . 6.2 mt -62.45 -56.59 16.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.002 0.429 . . . . 0.0 111.418 -178.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -77.36 -21.71 52.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.222 -174.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.417 ' HB3' ' O ' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -91.05 -27.94 18.28 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.578 -177.447 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -120.42 93.31 48.21 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . 0.446 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 31.5 Cg_exo -64.68 3.64 0.84 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 123.229 2.619 . . . . 0.0 114.067 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.495 ' O ' ' HG2' ' B' ' 83' ' ' LYS . 20.4 t70 -92.18 -22.45 19.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.619 HD11 ' HB2' ' B' ' 33' ' ' LEU . 53.5 mt -78.31 107.66 10.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.751 174.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.28 145.05 26.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.36 -175.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.589 HD12 ' HB2' ' B' ' 88' ' ' PHE . 11.1 tp -104.76 125.49 50.89 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.1 mp -102.33 116.61 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 175.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.764 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.72 121.5 41.76 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -176.445 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.39 96.48 4.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . 0.613 ' NE ' ' HA ' ' B' ' 46' ' ' ARG . 1.7 tpm_? -150.59 155.91 40.34 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.376 -175.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.42 ' HA ' ' HD3' ' B' ' 67' ' ' ARG . 1.0 OUTLIER -73.1 136.55 79.29 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.72 -177.898 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 -30.57 91.09 Favored 'Trans proline' 0 N--CA 1.466 -0.126 0 C-N-CA 122.742 2.294 . . . . 0.0 112.513 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -73.24 -42.88 62.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.949 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' GLU . . . . . 0.484 ' CD ' ' HZ1' ' B' ' 90' ' ' LYS . 0.0 OUTLIER -66.5 -33.2 75.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.181 174.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.727 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 tp -62.11 -33.87 75.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.629 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -70.2 -40.28 74.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.77 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.67 -41.49 13.34 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 3.1 mtp -97.65 -34.14 11.05 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.655 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 113.07 177.95 19.55 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.205 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' LYS . . . . . 0.727 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -147.24 160.72 38.81 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.463 ' HB2' HG23 ' B' ' 59' ' ' VAL . 11.9 Cg_endo -60.53 130.52 33.93 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.019 1.813 . . . . 0.0 112.887 -178.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -92.34 97.69 11.03 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 173.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.466 ' CG2' ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -139.83 159.41 27.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.29 -175.879 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -28.29 36.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.255 -176.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.446 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 13.4 p-10 -130.02 69.98 1.44 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.342 0.591 . . . . 0.0 111.633 -174.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' TYR . . . . . 0.764 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -136.45 142.53 43.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.274 176.696 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.685 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 34.2 mttm -127.69 121.9 31.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 -177.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -76.93 129.23 35.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.529 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' MET . . . . . 0.873 ' HB3' ' HB2' ' B' ' 70' ' ' LEU . 14.6 mmt -100.14 142.1 32.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.721 174.341 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.9 43.58 0.51 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -174.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' ARG . . . . . 0.42 ' HD3' ' HA ' ' B' ' 47' ' ' ASP . 26.6 mtm180 63.43 -77.44 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.636 0.775 . . . . 0.0 112.465 174.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -99.14 -45.05 2.27 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 111.425 -0.67 . . . . 0.0 111.425 -179.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' LYS . . . . . 0.448 ' O ' ' HD2' ' B' ' 72' ' ' PRO . 2.9 mttt -83.34 39.32 0.65 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.051 0.453 . . . . 0.0 110.33 174.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.873 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -71.87 -37.66 70.16 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.645 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.587 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.89 -57.08 11.03 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.09 -175.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . 0.464 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 9.6 Cg_exo -71.63 -17.67 29.57 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.21 1.94 . . . . 0.0 112.35 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.51 -22.81 40.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.878 0.37 . . . . 0.0 110.131 177.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.537 HD22 ' CD1' ' A' ' 7' ' ' PHE . 4.6 tp -57.19 -52.02 66.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.31 177.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.41 ' HB3' ' HB2' ' A' ' 8' ' ' ASP . . . -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.441 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . 0.464 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -71.46 -25.75 62.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.904 0.383 . . . . 0.0 111.019 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' SER . . . . . 0.685 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 47.7 m -78.19 -41.6 34.1 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.224 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.16 60.26 1.33 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.65 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 7.6 mt -94.72 151.15 19.51 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' B' ' 83' ' ' LYS . 0.0 OUTLIER -122.26 130.52 24.66 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' PRO . . . . . 0.428 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 59.5 Cg_exo -60.63 -6.95 6.39 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.697 2.931 . . . . 0.0 114.935 -171.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -90.6 -7.51 52.57 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.827 -0.545 . . . . 0.0 110.389 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' LYS . . . . . 0.495 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 4.3 mttp -82.02 126.09 75.75 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.607 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.547 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 5.9 Cg_exo -72.24 122.16 8.13 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.192 1.928 . . . . 0.0 109.969 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.462 ' CG2' HD13 ' B' ' 110' ' ' ILE . 13.0 m -127.62 153.21 36.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.101 0.477 . . . . 0.0 111.565 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.48 HG11 HD11 ' B' ' 42' ' ' LEU . 1.4 p -124.28 143.05 39.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 176.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 m -106.43 122.94 60.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.8 0.333 . . . . 0.0 110.513 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.767 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -91.69 123.58 35.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.852 -178.845 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . 0.569 ' O ' ' HB2' ' B' ' 90' ' ' LYS . 10.9 p -106.22 -165.26 1.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -168.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.569 ' HB2' ' O ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER 153.19 -22.72 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.854 1.662 . . . . 0.0 107.189 179.387 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -105.17 25.95 9.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.79 174.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.44 ' HB2' ' H ' ' B' ' 93' ' ' ALA . . . 50.04 -103.57 0.13 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.658 -1.155 . . . . 0.0 113.327 176.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . 0.44 ' H ' ' HB2' ' B' ' 92' ' ' ALA . . . -54.74 -28.24 46.89 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -170.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' ARG . . . . . 0.485 HH22 HG23 ' A' ' 15' ' ' VAL . 0.0 OUTLIER -69.72 -31.37 69.32 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.939 -0.705 . . . . 0.0 112.383 -174.343 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.28 -47.86 66.56 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 174.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' ALA . . . . . 0.416 ' O ' ' HB3' ' B' ' 100' ' ' LYS . . . -59.57 -34.29 72.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.172 177.246 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -72.94 -35.23 66.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.811 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' ALA . . . . . 0.55 ' HA ' ' HZ ' ' A' ' 11' ' ' PHE . . . -71.4 -44.18 65.42 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.034 0.445 . . . . 0.0 110.561 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 99' ' ' GLY . . . . . 0.529 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -76.02 -51.47 6.91 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.424 -177.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 100' ' ' LYS . . . . . 0.451 ' O ' ' HB2' ' B' ' 104' ' ' GLU . 0.0 OUTLIER -62.8 -31.77 72.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.907 0.353 . . . . 0.0 111.268 -174.791 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 10.8 m -73.03 -35.78 66.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.735 0.302 . . . . 0.0 110.98 175.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 102' ' ' LEU . . . . . 0.547 HD21 ' CE1' ' B' ' 107' ' ' PHE . 6.8 mt -62.65 -49.98 73.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.144 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 103' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -64.44 -27.01 68.7 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.874 0.368 . . . . 0.0 110.409 178.208 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.451 ' HB2' ' O ' ' B' ' 100' ' ' LYS . 4.7 tt0 -71.14 -8.42 53.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.029 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . 0.506 ' CZ ' ' HB ' ' A' ' 10' ' ' THR . 21.4 m-30 -112.01 -8.09 14.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.778 0.323 . . . . 0.0 111.117 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.66 49.7 0.34 Allowed Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.127 -1.035 . . . . 0.0 112.98 174.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' PHE . . . . . 0.547 ' CE1' HD21 ' B' ' 102' ' ' LEU . 2.0 m-85 -99.43 149.26 23.38 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . 0.463 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -63.01 -91.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.42 -175.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.463 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.9 OUTLIER -116.36 122.25 44.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.34 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' ILE . . . . . 0.555 HG12 ' HE2' ' B' ' 22' ' ' MET . 1.2 tt -120.22 129.13 75.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.275 0.559 . . . . 0.0 111.285 -175.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' TYR . . . . . 0.401 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 1.2 m-85 -116.59 148.68 40.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.067 -177.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.712 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 10.3 t-20 -115.52 143.09 45.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.45 ' HB3' ' HA ' ' B' ' 88' ' ' PHE . 13.7 p -80.97 133.97 35.61 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.425 0.631 . . . . 0.0 111.511 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -86.18 123.34 31.35 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.507 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . 0.711 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 97.2 -79.29 0.67 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.673 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . 0.414 ' O ' ' HB2' ' B' ' 119' ' ' LYS . . . 150.27 -175.89 29.13 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.915 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 117' ' ' MET . . . . . 0.721 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -61.87 -27.47 68.81 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.933 0.493 . . . . 0.0 111.697 -176.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.422 ' O ' ' HG3' ' B' ' 122' ' ' GLU . 7.5 p-10 -67.85 -24.29 65.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 119' ' ' LYS . . . . . 0.711 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -72.18 -32.86 67.2 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.783 178.273 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.767 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 23.7 t-105 -55.57 -48.77 74.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.956 0.407 . . . . 0.0 109.973 176.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.52 -37.76 87.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.756 176.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.434 ' HB2' ' HA ' ' B' ' 119' ' ' LYS . 21.0 mt-10 -67.9 -41.26 82.98 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -176.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . 0.664 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 3.9 mm-40 -74.02 -7.84 53.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.342 . . . . 0.0 110.992 -178.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.28 25.95 58.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.29 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.561 ' HG ' ' HB2' ' B' ' 123' ' ' GLU . 58.9 mt -80.44 159.97 68.57 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.56 0.219 . . . . 0.0 110.516 -178.112 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 18.5 Cg_endo -56.81 116.89 3.52 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.057 2.505 . . . . 0.0 112.121 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -126.86 149.18 49.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.461 -177.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.78 100.1 12.88 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.51 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.82 134.56 39.01 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.081 -173.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 9.5 ttm-85 -128.15 71.35 1.38 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.163 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -21.18 64.97 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.458 -174.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.32 109.9 20.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.824 0.345 . . . . 0.0 110.312 177.246 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -75.73 99.06 4.27 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.687 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 -67.58 103.96 1.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.221 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -171.57 111.68 0.32 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.562 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -139.38 170.21 16.35 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.633 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.556 -179.341 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' PS5 . . . . . 0.577 ' S2 ' ' HA ' ' A' ' 92' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 139' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -113.71 159.79 19.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.367 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.0 12.8 18.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.325 -178.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.752 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -55.7 -29.9 55.3 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.95 -177.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -39.81 79.58 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.799 0.333 . . . . 0.0 110.665 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -66.98 -58.45 4.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.562 -174.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.752 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 3.4 p90 -68.09 -25.32 65.27 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.975 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.25 -50.78 64.11 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.47 -45.34 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.787 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -47.53 77.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.796 0.331 . . . . 0.0 110.993 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.464 ' CD1' ' HB3' ' B' ' 71' ' ' GLU . 0.7 OUTLIER -57.12 -42.86 81.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.282 0.563 . . . . 0.0 109.787 179.027 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.24 -29.27 70.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.596 177.101 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.9 54.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.523 -178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -72.41 -49.38 34.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.027 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.716 HG23 HH21 ' A' ' 94' ' ' ARG . 3.0 t -60.51 -41.16 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -176.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -65.87 -27.6 68.34 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.65 -26.08 68.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.062 0.458 . . . . 0.0 111.099 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.15 -31.58 72.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.423 -178.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.49 ' HD2' ' SD ' ' A' ' 24' ' ' MET . 2.4 pttt -75.03 -20.18 59.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.908 0.385 . . . . 0.0 111.614 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -23.55 57.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.418 -177.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -85.61 4.56 35.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -175.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.526 ' HE3' HG23 ' A' ' 87' ' ' VAL . 1.0 OUTLIER -145.56 162.77 36.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.65 0.262 . . . . 0.0 110.829 178.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 20.8 t -77.29 113.01 15.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.811 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.547 ' HE3' ' HD2' ' A' ' 90' ' ' LYS . 0.3 OUTLIER -79.26 112.99 17.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.487 179.733 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.489 HD21 ' HA ' ' A' ' 25' ' ' LEU . 1.0 OUTLIER -124.62 145.28 49.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.086 0.469 . . . . 0.0 110.52 -178.57 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.36 141.45 36.92 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.168 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.11 -22.72 5.54 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 124.07 3.18 . . . . 0.0 114.997 -174.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.502 ' HD2' ' HA ' ' A' ' 28' ' ' LYS . 2.1 mmmm -73.65 -44.14 57.63 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.825 -0.547 . . . . 0.0 110.891 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.559 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 10.5 t0 -72.7 -37.29 67.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.853 176.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.48 -46.72 84.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.15 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.76 ' HH ' ' HG3' ' A' ' 126' ' ' PRO . 80.4 t80 -63.63 -42.8 98.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.804 -177.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -66.45 -41.54 88.97 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.813 -173.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 29' ' ' ASP . 0.3 OUTLIER -72.35 -27.38 62.38 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.598 176.082 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' A' ' 42' ' ' LEU . 1.9 mt -59.1 -50.56 73.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.767 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -76.26 -34.67 59.16 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.159 -177.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -70.47 -22.73 62.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.613 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -115.81 140.28 25.95 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-O 121.06 0.457 . . . . 0.0 111.659 -177.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.82 -9.4 10.93 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.778 2.318 . . . . 0.0 111.579 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.477 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -92.34 -67.02 0.88 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.299 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.751 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 52.3 mt -41.97 102.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.439 -175.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.511 ' HA ' ' HB2' ' A' ' 61' ' ' ASN . 26.4 m -101.85 145.09 29.68 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.271 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.697 ' HB2' HD12 ' A' ' 34' ' ' LEU . 18.1 tp -104.16 127.18 51.74 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.567 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 4.5 mt -106.69 114.57 46.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.087 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.788 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -100.41 135.78 41.31 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.627 -177.671 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -114.68 96.77 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 121.994 0.902 . . . . 0.0 109.809 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.652 ' NE ' ' HA ' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -143.4 142.52 31.27 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.611 177.468 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.505 ' HA ' ' NH2' ' A' ' 67' ' ' ARG . 5.9 m-20 -71.94 140.34 83.36 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -174.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.401 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 1.1 Cg_endo -52.76 -27.41 34.02 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 123.585 2.857 . . . . 0.0 114.362 -168.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' B' ' 49' ' ' ASP . 0.7 OUTLIER -79.92 -31.62 40.11 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.903 178.403 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -36.92 72.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.982 0.42 . . . . 0.0 110.105 176.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.524 HD11 ' HB3' ' A' ' 46' ' ' ARG . 1.6 tp -60.65 -33.9 73.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.416 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 48' ' ' PRO . 23.2 mttt -70.79 -38.59 73.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.261 177.925 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.83 -48.02 19.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.548 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 21.8 mmm -102.64 -34.02 9.23 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.556 -173.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 121.61 179.63 16.06 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.299 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.484 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -132.81 150.98 77.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.431 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 37.9 Cg_exo -62.34 134.91 50.93 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.514 2.143 . . . . 0.0 113.021 -176.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.469 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 26.9 t70 -101.26 92.35 4.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.699 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.553 HG23 ' HB2' ' A' ' 62' ' ' TYR . 5.3 m -133.63 159.31 42.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.068 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -57.35 -41.42 80.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.303 -177.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 41' ' ' THR . 0.1 OUTLIER -121.4 82.33 1.92 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.745 -177.305 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.788 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 3.2 t80 -120.31 125.94 49.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.567 ' O ' ' HA ' ' A' ' 43' ' ' ILE . 11.3 mttm -122.13 120.62 34.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.016 0.436 . . . . 0.0 110.123 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.436 ' HD2' ' O ' ' A' ' 44' ' ' ASP . 12.9 t-160 -88.24 128.32 35.46 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.233 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.5 ' HE2' HG12 ' A' ' 43' ' ' ILE . 0.1 OUTLIER -126.56 171.97 10.64 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.075 0.465 . . . . 0.0 109.761 175.765 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.626 ' HA ' ' NH1' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -101.01 -176.77 3.26 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 174.041 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.626 ' NH1' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -93.31 -62.87 1.29 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.913 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.721 ' CA ' ' HB2' ' B' ' 94' ' ' ARG . . . -91.35 6.71 80.84 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.11 -0.567 . . . . 0.0 112.163 176.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.597 ' HB3' ' CB ' ' A' ' 66' ' ' SER . 1.1 tppp? -124.54 13.2 8.73 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.579 HD22 ' CZ ' ' B' ' 11' ' ' PHE . 0.0 OUTLIER -72.09 -32.29 66.87 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.191 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.885 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.1 mt-10 -47.35 -62.08 2.36 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.162 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.885 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 3.4 Cg_exo -75.12 -17.36 19.36 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.493 2.129 . . . . 0.0 113.711 178.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -90.0 -27.51 19.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -173.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.52 -28.84 66.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.23 0.538 . . . . 0.0 110.384 -177.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -76.91 -33.26 57.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.224 173.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . 0.646 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 11.4 mttt -62.69 -29.77 70.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.86 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -41.07 24.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.695 0.283 . . . . 0.0 110.874 -177.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.49 52.07 2.07 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.582 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.408 ' HB3' ' HZ ' ' A' ' 107' ' ' PHE . 3.5 mt -75.81 143.58 41.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.407 0.146 . . . . 0.0 110.636 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.465 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -114.19 136.06 22.21 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.665 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.465 ' HD3' ' HA ' ' A' ' 80' ' ' ASP . 25.6 Cg_exo -69.57 1.01 4.68 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.842 2.361 . . . . 0.0 114.06 -172.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.627 ' HA ' ' HD2' ' A' ' 108' ' ' LYS . 3.9 mt-10 -99.89 -7.1 25.7 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 121.996 -0.44 . . . . 0.0 110.715 178.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.443 ' HZ2' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -84.19 118.65 71.77 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.277 177.485 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.751 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 8.4 Cg_exo -67.79 108.86 1.76 Allowed 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.45 2.1 . . . . 0.0 110.16 174.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.473 HG11 ' HB ' ' A' ' 41' ' ' THR . 9.0 m -114.64 154.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.292 0.568 . . . . 0.0 111.576 -172.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.657 HG11 HD11 ' A' ' 42' ' ' LEU . 1.5 p -123.85 142.56 40.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.264 177.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.823 ' HB ' ' HB3' ' A' ' 95' ' ' ALA . 6.0 m -108.46 126.09 65.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.764 ' O ' ' HB2' ' A' ' 89' ' ' CYS . 3.7 t80 -100.83 126.21 47.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.947 -0.569 . . . . 0.0 112.062 -171.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' CYS . . . . . 0.764 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.1 OUTLIER 102.61 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 O-C-N 124.957 1.411 . . . . 0.0 110.934 179.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.547 ' HD2' ' HE3' ' A' ' 24' ' ' MET . 0.2 OUTLIER -100.31 -34.09 10.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.771 -177.717 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.501 ' HB ' ' S4 ' ' A' ' 138' ' ' PS5 . 0.2 OUTLIER -79.59 -77.66 0.18 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -175.695 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.456 ' HB1' ' S4 ' ' A' ' 138' ' ' PS5 . . . -58.97 -56.17 25.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.714 0.292 . . . . 0.0 111.651 -176.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.736 ' HB2' ' HB3' ' A' ' 89' ' ' CYS . . . -76.2 -49.58 16.8 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -177.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.716 HH21 HG23 ' A' ' 15' ' ' VAL . 0.0 OUTLIER 74.19 70.58 0.11 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.715 0.634 . . . . 0.0 110.69 -174.795 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.823 ' HB3' ' HB ' ' A' ' 87' ' ' VAL . . . -69.06 -2.51 10.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.672 -178.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.95 -29.57 60.36 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.16 -34.49 71.01 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.829 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.89 61.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.915 0.388 . . . . 0.0 110.749 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.42 -53.23 3.91 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.945 -175.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.426 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -61.49 -33.39 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 122.545 -0.385 . . . . 0.0 111.763 -172.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.426 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 3.5 m -71.55 -36.39 70.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 110.921 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 15.0 mt -69.92 -44.2 70.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.568 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.523 ' HB3' HG23 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -63.91 -31.51 72.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.75 0.309 . . . . 0.0 110.735 -179.037 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.09 -5.22 50.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.262 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -103.41 -10.51 18.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.052 177.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.21 1.27 3.24 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 119.753 -1.213 . . . . 0.0 113.93 174.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.516 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 8.0 m-85 -67.69 136.82 54.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.212 0.506 . . . . 0.0 110.403 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.627 ' HD2' ' HA ' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -67.12 -81.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.715 -174.327 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.416 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -112.19 113.59 25.92 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.825 -177.106 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.523 HG23 ' HB3' ' A' ' 103' ' ' ARG . 0.7 OUTLIER -117.23 127.7 74.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.212 0.529 . . . . 0.0 110.479 -179.67 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.524 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 13.6 m-85 -112.69 145.0 41.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.996 -176.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.452 ' HA ' HG21 ' A' ' 87' ' ' VAL . 9.5 t-20 -112.0 136.68 51.03 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.532 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 16.4 m -91.73 117.63 29.93 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -55.94 121.6 9.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.733 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.448 ' H ' ' HG2' ' A' ' 90' ' ' LYS . . . 86.84 -108.34 3.32 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.983 -177.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.549 ' HA3' ' S1 ' ' A' ' 138' ' ' PS5 . . . 159.06 -154.83 25.9 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.034 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' MET . . . . . 0.434 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 16.7 ttp -50.67 -33.65 23.44 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.844 0.457 . . . . 0.0 111.748 -177.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.526 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 27.0 t70 -58.43 -40.37 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.084 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -73.96 -31.94 63.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.632 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.725 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 22.5 t-105 -59.51 -53.86 53.27 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.463 HD21 ' HA ' ' A' ' 121' ' ' LEU . 7.0 mt -65.23 -38.91 91.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.95 177.551 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.526 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -66.21 -44.8 82.84 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.707 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -81.78 20.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -175.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 65.66 24.8 71.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.251 -0.5 . . . . 0.0 113.153 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' A' ' 125' ' ' LEU . 17.6 mt -83.44 152.05 63.37 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.852 0.358 . . . . 0.0 110.702 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.76 ' HG3' ' HH ' ' A' ' 31' ' ' TYR . 33.8 Cg_endo -66.01 118.71 5.73 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.79 2.326 . . . . 0.0 112.835 -176.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.76 149.84 42.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.434 175.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -102.61 124.9 48.99 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.514 -177.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -129.08 150.74 50.35 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.558 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -80.38 -30.12 37.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.014 0.435 . . . . 0.0 110.401 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.04 149.69 50.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.229 178.104 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 64.77 22.89 12.64 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.439 0.638 . . . . 0.0 110.423 -175.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -141.06 19.88 2.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.975 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 -135.68 36.33 2.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.396 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -90.8 61.13 4.66 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.064 0.459 . . . . 0.0 110.261 176.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -175.23 164.26 3.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.391 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.87 176.561 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.678 0.275 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -88.73 162.93 15.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.883 176.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.85 10.07 22.47 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -175.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . 0.608 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.14 -35.21 63.93 Favored Glycine 0 C--O 1.224 -0.476 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.921 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -33.61 58.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.841 0.353 . . . . 0.0 111.258 178.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -68.19 -56.46 8.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.608 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.9 OUTLIER -74.46 -22.27 59.18 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.583 -177.498 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -53.11 -50.1 65.15 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.819 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.21 -38.56 77.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.428 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -46.4 64.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 0.0 110.619 178.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' PHE . . . . . 0.579 ' CZ ' HD22 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -56.01 -48.85 75.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.451 -179.158 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' LYS . . . . . 0.619 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -62.47 -26.13 68.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.534 179.08 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.7 -44.4 56.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.068 0.461 . . . . 0.0 111.409 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.3 -49.83 31.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.902 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.407 HG22 ' CE1' ' B' ' 11' ' ' PHE . 1.9 t -64.09 -34.27 67.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.319 -175.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.619 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -64.02 -27.89 69.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.552 0.215 . . . . 0.0 111.345 178.747 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -25.57 68.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.94 0.4 . . . . 0.0 110.887 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.65 -32.5 64.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.882 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -78.15 -23.08 47.86 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.481 0.658 . . . . 0.0 110.366 171.939 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.58 -18.88 58.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.803 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -79.89 -2.29 42.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.282 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.595 ' HE2' ' HA3' ' B' ' 99' ' ' GLY . 1.0 OUTLIER -139.63 172.72 12.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 111.076 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 17.6 t -82.09 112.44 19.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.729 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' MET . . . . . 0.615 ' SD ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -72.7 100.47 2.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.764 -0.198 . . . . 0.0 110.524 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . 0.493 ' O ' ' HA ' ' B' ' 113' ' ' SER . 1.2 mt -117.68 134.2 55.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.146 0.498 . . . . 0.0 110.449 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.38 152.33 70.25 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.521 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 6.9 Cg_endo -51.72 -20.93 10.3 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 123.661 2.907 . . . . 0.0 114.701 -174.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.414 ' HD2' ' HA ' ' B' ' 28' ' ' LYS . 5.8 mmmm -75.44 -48.01 24.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.102 0.477 . . . . 0.0 110.975 176.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.81 -31.37 64.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.689 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.14 -43.92 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.63 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' TYR . . . . . 0.446 ' HA ' HD11 ' B' ' 34' ' ' LEU . 89.3 t80 -68.55 -31.7 71.11 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.065 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -53.7 55.15 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.054 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.58 ' HB2' HD11 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -74.46 -27.33 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.134 179.779 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.446 HD11 ' HA ' ' B' ' 31' ' ' TYR . 5.7 mt -57.74 -55.0 40.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.06 -177.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . 0.859 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 15.6 mm100 -74.59 -19.03 60.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.907 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -35.08 15.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.754 0.312 . . . . 0.0 111.478 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 1.2 m-80 -92.43 127.33 49.09 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -76.76 -9.55 18.33 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.632 2.221 . . . . 0.0 111.285 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.402 ' CG ' ' HG3' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -90.99 -69.45 0.73 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 177.168 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.765 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 53.6 mt -44.11 109.75 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.833 -175.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.424 HG23 ' HG3' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -106.49 145.75 31.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.003 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.649 HD13 ' HB2' ' B' ' 88' ' ' PHE . 13.9 tp -102.44 124.41 47.97 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 96.4 mt -103.84 113.11 39.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.806 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.91 137.43 39.3 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.221 -177.434 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -115.34 97.19 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 121.87 0.843 . . . . 0.0 110.04 175.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . 0.716 ' HG2' ' HE1' ' B' ' 117' ' ' MET . 0.8 OUTLIER -148.41 134.29 19.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.423 177.715 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.412 ' HA ' ' NH2' ' B' ' 67' ' ' ARG . 0.1 OUTLIER -69.83 147.63 96.2 Favored Pre-proline 0 C--N 1.318 -0.78 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.056 -171.22 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -49.9 -32.74 31.14 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 124.055 3.17 . . . . 0.0 113.869 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.671 ' HB3' ' HB3' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -71.25 -43.05 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.724 0.297 . . . . 0.0 110.896 -179.407 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' GLU . . . . . 0.465 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 8.0 mt-10 -67.27 -36.97 82.67 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.7 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.435 HD11 ' HB3' ' B' ' 46' ' ' ARG . 0.5 OUTLIER -61.8 -34.58 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.796 177.319 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -72.79 -41.43 64.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.928 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.02 -48.47 16.09 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -173.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -99.48 -35.63 9.82 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.628 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.62 -175.93 16.11 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.616 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.61 160.27 64.11 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.43 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 25.5 Cg_exo -63.0 124.86 14.72 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.223 1.949 . . . . 0.0 112.913 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . 0.81 ' HB3' ' HB2' ' B' ' 126' ' ' PRO . 25.6 t70 -90.35 88.06 7.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.013 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.558 HG23 ' HB2' ' B' ' 62' ' ' TYR . 3.6 m -134.98 167.51 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . 0.859 ' HD2' ' HA ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -76.04 -27.84 57.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.929 0.395 . . . . 0.0 111.17 -176.88 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -122.65 68.77 0.97 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.458 -175.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' TYR . . . . . 0.806 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.3 t80 -121.79 127.49 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.816 0.341 . . . . 0.0 110.345 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.694 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 61.8 mttm -122.83 122.33 38.41 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 177.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -88.87 133.18 34.37 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 -177.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' MET . . . . . 0.505 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER -134.53 170.67 15.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.085 0.469 . . . . 0.0 110.796 179.319 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' SER . . . . . 0.414 ' HA ' ' NH1' ' B' ' 67' ' ' ARG . 0.7 OUTLIER -91.6 -177.33 4.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.509 174.765 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' ARG . . . . . 0.414 ' NH1' ' HA ' ' B' ' 66' ' ' SER . 0.0 OUTLIER -90.73 -46.86 7.99 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.418 -177.531 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . 0.509 ' CA ' ' HD3' ' A' ' 94' ' ' ARG . . . -100.3 -44.22 2.22 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 175.693 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 5.4 tttt -77.79 29.18 0.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.145 0.498 . . . . 0.0 110.432 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.72 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER -76.31 -47.01 25.1 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.691 177.722 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.72 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -54.38 -46.56 98.99 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -174.659 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . 0.53 ' HD3' ' OE1' ' B' ' 71' ' ' GLU . 58.3 Cg_endo -71.18 -20.14 28.72 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.333 1.355 . . . . 0.0 111.921 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.505 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -86.33 -26.47 24.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.189 0.518 . . . . 0.0 110.015 177.404 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.596 HD23 HD22 ' B' ' 102' ' ' LEU . 4.6 tp -58.0 -52.75 64.21 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.958 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.69 -28.49 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.636 -175.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -91.75 -13.48 31.51 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.361 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' SER . . . . . 0.694 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 20.3 m -72.86 -27.67 62.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.897 0.38 . . . . 0.0 110.5 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . 0.406 ' O ' ' HE3' ' B' ' 63' ' ' LYS . . . 90.77 64.02 1.21 Allowed Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.433 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.404 HD11 ' HG ' ' B' ' 74' ' ' LEU . 5.2 mt -113.31 140.69 47.79 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.649 0.262 . . . . 0.0 110.406 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.867 ' HB3' ' HE3' ' B' ' 83' ' ' LYS . 3.3 t70 -114.55 133.03 22.58 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' PRO . . . . . 0.609 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 10.0 Cg_endo -57.6 -10.03 6.37 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.599 2.866 . . . . 0.0 115.266 -171.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.54 -10.53 34.52 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.679 -0.638 . . . . 0.0 110.924 179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' LYS . . . . . 0.867 ' HE3' ' HB3' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -78.7 121.2 83.26 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.534 -177.407 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.765 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 4.8 Cg_exo -72.87 117.47 5.14 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.436 2.091 . . . . 0.0 109.984 173.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 12.3 m -121.1 158.24 23.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-O 121.313 0.578 . . . . 0.0 111.457 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.97 140.6 44.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . 0.698 ' HB ' ' HB3' ' B' ' 95' ' ' ALA . 1.8 m -110.84 122.48 65.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.122 0.487 . . . . 0.0 110.13 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.771 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -81.34 161.39 23.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.376 -175.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 65.98 88.34 0.11 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 171.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.481 ' HA ' ' HA ' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -100.99 -31.27 11.19 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 167.864 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' THR . . . . . 0.4 ' O ' ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -55.18 -52.09 64.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.337 -175.84 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.475 ' O ' ' HG2' ' A' ' 67' ' ' ARG . . . -103.56 -52.16 3.05 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.537 -178.083 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -76.62 -45.36 30.44 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -175.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' ARG . . . . . 0.721 ' HB2' ' CA ' ' A' ' 68' ' ' GLY . 5.6 ttp180 72.75 74.65 0.15 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.577 0.704 . . . . 0.0 110.482 -170.96 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.698 ' HB3' ' HB ' ' B' ' 87' ' ' VAL . . . -67.06 -1.15 3.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.213 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.03 -29.36 63.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.787 -176.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -76.98 -31.33 56.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.819 0.343 . . . . 0.0 110.879 177.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' ALA . . . . . 0.442 ' HB3' HD11 ' B' ' 70' ' ' LEU . . . -74.88 -35.1 62.31 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.025 -179.797 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 99' ' ' GLY . . . . . 0.595 ' HA3' ' HE2' ' B' ' 22' ' ' MET . . . -94.7 -54.92 1.47 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.443 -0.884 . . . . 0.0 114.273 -174.069 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -28.44 67.87 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 122.399 -0.471 . . . . 0.0 111.981 -171.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.53 -35.83 70.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.892 0.377 . . . . 0.0 111.109 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 102' ' ' LEU . . . . . 0.596 HD22 HD23 ' B' ' 74' ' ' LEU . 15.4 mt -63.81 -46.61 84.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.751 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 103' ' ' ARG . . . . . 0.532 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.0 OUTLIER -66.02 -26.86 67.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.833 0.349 . . . . 0.0 110.725 -179.215 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.02 -6.16 36.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.219 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -110.56 -9.2 14.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.221 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 130.28 5.18 4.28 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.918 -1.134 . . . . 0.0 113.58 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' PHE . . . . . 0.609 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 5.9 m-85 -66.05 135.35 54.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.177 0.489 . . . . 0.0 110.276 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 6.3 mttt -61.24 -84.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.563 -174.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.35 119.13 35.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.095 0.474 . . . . 0.0 110.837 -178.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' ILE . . . . . 0.559 ' O ' HG21 ' B' ' 110' ' ' ILE . 0.4 OUTLIER -117.34 128.38 74.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-O 121.177 0.513 . . . . 0.0 110.588 -178.192 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -115.41 146.56 41.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.121 -175.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.615 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 4.5 t-20 -114.47 141.9 47.09 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.493 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 14.6 m -86.9 105.58 17.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.25 0.548 . . . . 0.0 111.611 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 21.75 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.929 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -116.44 -66.44 0.38 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.182 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 123.53 170.48 13.4 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.444 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 117' ' ' MET . . . . . 0.716 ' HE1' ' HG2' ' B' ' 46' ' ' ARG . 1.0 OUTLIER -63.16 -34.71 78.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.021 0.439 . . . . 0.0 110.484 -179.549 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.408 ' CG ' ' HZ1' ' B' ' 119' ' ' LYS . 2.7 p-10 -62.1 -31.13 71.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.053 178.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 119' ' ' LYS . . . . . 0.521 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -72.81 -32.12 65.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.963 179.392 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.771 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.7 t-105 -60.21 -53.86 52.7 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 177.581 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.42 HD21 ' HA ' ' B' ' 121' ' ' LEU . 6.5 mt -63.93 -40.92 97.58 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -63.57 -43.85 95.82 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.885 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -72.0 1.38 7.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.672 -176.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.12 27.47 66.25 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.932 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 85.5 mt -82.66 150.99 64.0 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . 0.81 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 13.5 Cg_endo -57.68 128.39 29.02 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 123.084 2.522 . . . . 0.0 112.547 -176.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.81 142.97 46.23 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.294 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.66 101.73 13.32 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -129.35 145.03 51.45 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.979 -174.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -67.2 -30.12 69.97 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 131' ' ' SER . . . . . 0.517 ' O ' ' HB2' ' B' ' 132' ' ' HIS . 0.7 OUTLIER -65.68 164.28 14.76 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.644 178.773 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 132' ' ' HIS . . . . . 0.517 ' HB2' ' O ' ' B' ' 131' ' ' SER . 22.1 m80 75.5 6.1 4.03 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.491 -172.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -133.14 -167.95 2.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.714 176.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 56.8 41.44 28.09 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.392 0.432 . . . . 0.0 111.178 176.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.12 -38.16 16.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.164 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 20.3 p-80 -111.25 132.54 54.27 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.076 176.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.369 -0.824 . . . . 0.0 109.504 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' PS5 . . . . . 0.549 ' S1 ' ' HA3' ' A' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 139' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.232 0 CA-C-O 121.277 0.561 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -149.5 52.88 0.94 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.819 0.818 . . . . 0.0 109.031 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.437 ' HE3' ' HD2' ' B' ' 81' ' ' PRO . 2.1 mpp? -77.05 10.95 2.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.892 -175.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.728 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -53.52 -32.76 46.41 Favored Glycine 0 C--O 1.226 -0.402 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.876 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.88 -32.55 74.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.994 0.425 . . . . 0.0 111.418 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.4 mmtm -69.79 -57.73 4.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.924 -175.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.728 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 4.9 p90 -77.79 -28.38 50.46 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.311 -0.556 . . . . 0.0 112.165 -174.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -45.0 71.11 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.006 0.431 . . . . 0.0 110.563 -177.732 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.63 -41.85 95.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.226 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -44.5 75.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.015 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -53.98 -46.84 71.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.264 0.554 . . . . 0.0 110.358 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.421 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.95 -26.53 65.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.466 178.235 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.86 -41.45 74.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.981 0.419 . . . . 0.0 110.602 177.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -71.32 -49.78 39.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.445 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.408 HG12 ' HG2' ' B' ' 71' ' ' GLU . 1.1 t -65.63 -35.77 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.951 -174.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.421 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.2 mttt -63.57 -30.2 71.35 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.803 0.335 . . . . 0.0 111.184 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.82 -26.37 68.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.145 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.55 -32.94 64.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.97 -178.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -78.42 -23.43 46.69 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.382 0.611 . . . . 0.0 110.582 172.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.01 -18.17 38.01 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.38 -22.26 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.889 -175.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.649 ' HE3' HG23 ' A' ' 87' ' ' VAL . 4.3 ptm -127.43 179.55 5.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.668 0.271 . . . . 0.0 111.018 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.5 t -80.14 108.24 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.471 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.13 121.6 25.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.944 0.402 . . . . 0.0 110.644 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.462 ' O ' ' HA ' ' A' ' 113' ' ' SER . 3.6 mt -134.73 143.61 47.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.065 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.98 141.88 75.48 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.888 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.595 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 5.8 Cg_endo -49.83 -22.92 7.84 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.825 3.017 . . . . 0.0 114.331 -175.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -45.83 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.076 -0.39 . . . . 0.0 110.642 174.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -68.32 -29.49 68.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.195 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.61 -46.06 49.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.779 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.589 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 66.5 t80 -66.26 -28.53 68.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 0.0 110.768 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -53.58 56.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -73.43 -27.39 61.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.711 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.643 HD12 ' HB2' ' A' ' 42' ' ' LEU . 1.1 mt -60.71 -55.25 35.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -74.0 -26.75 60.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.028 -176.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -79.08 -40.11 32.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.934 0.397 . . . . 0.0 110.584 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.4 ' C ' ' H ' ' A' ' 39' ' ' ASP . 15.2 m-80 -118.78 100.51 50.97 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.669 -176.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -68.13 5.08 1.25 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.977 2.451 . . . . 0.0 112.394 178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.4 ' H ' ' C ' ' A' ' 37' ' ' ASN . 0.6 OUTLIER -84.73 -33.12 23.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.552 174.475 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.662 HG12 ' HB2' ' A' ' 84' ' ' PRO . 13.9 mt -86.63 106.93 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.389 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.45 HG21 ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -95.65 146.41 24.51 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.686 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.643 ' HB2' HD12 ' A' ' 34' ' ' LEU . 7.9 tp -98.45 127.62 44.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 83.1 mt -111.86 121.85 65.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -109.3 148.14 31.52 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.226 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.39 98.82 5.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.542 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 8.5 mmm-85 -156.28 -170.81 3.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.669 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -100.02 129.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.843 0.354 . . . . 0.0 110.268 176.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.05 -19.34 65.91 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.684 2.256 . . . . 0.0 113.086 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -72.01 -51.26 22.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.779 0.324 . . . . 0.0 111.061 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.475 ' HB3' ' CB ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -73.16 -27.6 61.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.338 177.137 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.602 HD23 ' CE1' ' A' ' 64' ' ' HIS . 0.7 OUTLIER -58.98 -46.69 87.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.111 174.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -30.89 71.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.72 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.29 -48.3 11.38 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 36.6 mtm -92.24 -34.45 14.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -171.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 139.19 146.12 4.87 Favored Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.541 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.44 ' HE3' HD11 ' A' ' 128' ' ' LEU . 0.0 OUTLIER -133.44 141.52 40.7 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 177.509 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.429 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 9.4 Cg_endo -56.98 121.9 10.88 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.547 2.165 . . . . 0.0 112.438 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -93.22 93.38 8.21 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.546 ' CG2' ' HB2' ' A' ' 62' ' ' TYR . 15.9 m -132.07 162.48 39.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.31 83.44 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.45 ' HB2' HG21 ' A' ' 41' ' ' THR . 19.4 p-10 -128.75 79.9 1.94 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.571 0.7 . . . . 0.0 111.286 -174.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.546 ' HB2' ' CG2' ' A' ' 59' ' ' VAL . 9.3 t80 -122.3 129.86 52.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.279 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 0.0 OUTLIER -125.07 122.39 37.06 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.183 0.516 . . . . 0.0 110.934 178.911 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.602 ' CE1' HD23 ' A' ' 51' ' ' LEU . 2.7 t-160 -92.0 116.95 29.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.426 177.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.901 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -118.05 102.58 9.14 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.655 0.264 . . . . 0.0 110.791 -176.747 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.412 ' HB2' ' H ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -94.88 -103.37 0.15 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.976 -174.279 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.675 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.4 OUTLIER 56.6 -139.42 0.92 Allowed 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -173.188 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.652 ' HA2' HG23 ' B' ' 91' ' ' THR . . . -89.25 -44.27 5.06 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 119.599 -1.286 . . . . 0.0 110.574 174.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.518 ' HG2' ' HD2' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -151.73 45.04 0.77 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.785 -0.208 . . . . 0.0 110.849 174.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.901 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 68.43 -12.93 0.32 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 171.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.596 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -44.67 -58.5 5.22 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -173.443 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.675 ' HG2' ' HG2' ' A' ' 67' ' ' ARG . 13.3 Cg_exo -73.16 -16.95 25.01 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 122.079 1.853 . . . . 0.0 113.209 -175.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.707 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -96.46 -15.33 21.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.651 0.262 . . . . 0.0 110.685 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.484 HD22 ' CD1' ' B' ' 7' ' ' PHE . 30.6 tp -58.16 -54.95 41.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.168 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.76 -16.41 61.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.838 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -88.58 -17.9 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.575 ' HB3' ' HE3' ' A' ' 65' ' ' MET . 0.2 OUTLIER -100.84 43.85 1.04 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.766 -175.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 43.47 64.7 1.73 Allowed Glycine 0 C--N 1.335 0.477 0 O-C-N 123.616 0.573 . . . . 0.0 113.459 175.667 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.434 HD11 HD13 ' A' ' 74' ' ' LEU . 8.0 mt -116.32 128.64 55.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.131 0.491 . . . . 0.0 111.033 -177.591 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.403 ' C ' ' H ' ' A' ' 82' ' ' GLU . 0.6 OUTLIER -129.82 149.93 74.44 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.809 178.373 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.36 17.75 0.28 Allowed 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.889 2.393 . . . . 0.0 113.59 -174.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.403 ' H ' ' C ' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -120.21 6.17 10.75 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.083 0.468 . . . . 0.0 110.179 176.554 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.1 mttm -106.88 133.8 20.12 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.662 ' HB2' HG12 ' A' ' 40' ' ' ILE . 2.5 Cg_endo -77.74 141.54 19.51 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.732 2.288 . . . . 0.0 110.721 175.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.731 HG22 HD13 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -143.93 148.32 18.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.834 0.349 . . . . 0.0 110.624 -177.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.449 HG11 HD11 ' A' ' 42' ' ' LEU . 1.4 p -123.86 140.05 48.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.649 HG23 ' HE3' ' A' ' 22' ' ' MET . 13.3 m -108.57 134.72 49.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.345 -176.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.835 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.4 t80 -101.06 162.68 12.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.225 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' CYS . . . . . 0.507 ' HA ' ' HA2' ' A' ' 116' ' ' GLY . 0.1 OUTLIER 68.49 109.5 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 174.303 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.672 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -136.23 18.52 3.18 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.239 175.644 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.73 22.49 15.85 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -177.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -174.29 -66.07 0.01 OUTLIER 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.171 0.51 . . . . 0.0 110.438 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' A' ' 94' ' ' ARG . . . -74.44 -45.89 43.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.589 179.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.768 ' HG3' ' HG2' ' B' ' 69' ' ' LYS . 0.0 OUTLIER 75.69 91.15 0.08 Allowed 'General case' 0 N--CA 1.465 0.276 0 O-C-N 124.096 0.873 . . . . 0.0 111.011 -179.809 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.555 ' CB ' ' HB ' ' A' ' 87' ' ' VAL . . . -66.27 -2.87 4.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.941 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.84 -31.91 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.697 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.64 -33.69 76.21 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.616 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.18 -49.73 18.54 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.039 0.447 . . . . 0.0 110.913 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.501 ' HA2' HD12 ' A' ' 110' ' ' ILE . . . -75.79 -51.69 6.93 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.46 -0.791 . . . . 0.0 114.127 -173.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.472 ' HZ3' ' CD ' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -65.33 -30.57 71.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.914 0.387 . . . . 0.0 111.056 -174.282 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 32.7 m -72.16 -36.75 69.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.912 176.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.1 mt -68.05 -42.91 79.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.517 179.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.711 ' HB3' HG23 ' A' ' 110' ' ' ILE . 4.0 ptm180 -67.7 -27.24 66.66 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.849 0.357 . . . . 0.0 110.361 179.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.472 ' CD ' ' HZ3' ' A' ' 100' ' ' LYS . 0.5 OUTLIER -69.75 -6.91 35.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.361 174.644 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.517 ' CE1' ' HB ' ' B' ' 10' ' ' THR . 22.5 m-85 -107.4 -12.11 15.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.683 0.278 . . . . 0.0 110.762 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.46 50.98 0.73 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.323 173.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 2.0 m-85 -88.43 -179.84 6.17 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.679 -0.307 . . . . 0.0 110.584 177.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.454 ' HB3' ' H ' ' A' ' 109' ' ' THR . 5.4 mttt -85.46 -97.02 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.655 -178.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.454 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -112.19 115.91 29.59 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.742 0.305 . . . . 0.0 110.554 179.041 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.731 HD13 HG22 ' A' ' 85' ' ' VAL . 1.5 tt -118.05 127.72 75.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.068 0.461 . . . . 0.0 110.743 -176.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -115.62 144.95 43.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.625 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.566 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 4.1 t-20 -107.87 136.14 48.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 171.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.462 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.1 m -88.45 108.76 19.55 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.704 0.287 . . . . 0.0 111.759 -175.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -58.89 135.59 57.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.296 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.609 ' O ' ' HG3' ' A' ' 90' ' ' LYS . . . 93.1 -106.88 3.47 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.75 -174.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.538 ' H ' ' HB2' ' A' ' 119' ' ' LYS . . . 160.79 -156.97 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' MET . . . . . 0.468 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 2.2 ttm -59.02 -33.68 71.02 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.203 0.525 . . . . 0.0 109.987 177.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.8 OUTLIER -61.73 -32.28 72.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.014 177.205 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.595 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -74.6 -32.75 62.46 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 122.168 0.187 . . . . 0.0 111.476 178.94 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.835 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 24.8 t-105 -59.83 -53.32 59.35 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.5 mt -64.84 -38.94 92.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.967 177.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.7 OUTLIER -65.51 -35.77 81.85 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.873 0.368 . . . . 0.0 111.483 -178.294 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.711 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.0 tp10 -79.43 -3.89 48.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.3 29.18 68.74 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 121.056 -0.593 . . . . 0.0 112.041 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.711 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 52.3 mt -80.94 160.65 65.69 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-O 120.679 0.276 . . . . 0.0 110.879 -176.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.53 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 21.0 Cg_endo -58.47 117.58 4.32 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.079 2.519 . . . . 0.0 112.47 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.4 m -128.44 146.39 50.82 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.44 HD11 ' HE3' ' A' ' 56' ' ' LYS . 3.2 mt -99.36 103.1 14.88 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.077 0.465 . . . . 0.0 110.105 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -115.7 142.21 47.05 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.676 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.66 79.08 2.21 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 176.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.83 113.86 1.02 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.965 -1.016 . . . . 0.0 112.646 -170.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.69 86.66 3.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 173.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.9 -8.83 57.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.661 -173.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -67.69 -29.45 68.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.747 0.308 . . . . 0.0 110.775 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -78.54 80.13 4.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.183 0.516 . . . . 0.0 111.443 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 50.1 p-80 -86.26 -20.04 29.05 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.63 171.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 46.9 t60 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.153 -1.403 . . . . 0.0 107.327 176.826 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.406 0.622 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -138.24 65.29 1.47 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.362 -176.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' MET . . . . . 0.542 ' HG3' ' HG3' ' B' ' 6' ' ' LYS . 1.9 mpp? -78.82 2.88 18.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.279 -175.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . 0.705 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.31 -39.24 81.9 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.633 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -63.48 -33.04 74.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.299 -0.451 . . . . 0.0 111.421 176.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.542 ' HG3' ' HG3' ' B' ' 3' ' ' MET . 1.7 mmmt -71.27 -52.24 20.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.626 -175.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.705 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 2.2 p90 -82.41 -24.31 34.44 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.267 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.92 -49.49 65.87 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.777 0.322 . . . . 0.0 110.683 -179.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.67 -44.71 77.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.255 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' THR . . . . . 0.517 ' HB ' ' CE1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -64.89 -42.86 94.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.938 179.132 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' PHE . . . . . 0.448 ' O ' ' HB ' ' B' ' 15' ' ' VAL . 0.5 OUTLIER -57.85 -47.96 81.17 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.013 0.435 . . . . 0.0 110.428 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' LYS . . . . . 0.605 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.41 -25.9 68.22 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.185 177.597 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.21 -47.53 27.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.101 0.477 . . . . 0.0 111.262 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.89 -50.37 35.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.688 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.508 HG12 ' NH2' ' B' ' 94' ' ' ARG . 0.5 OUTLIER -60.2 -33.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.633 -176.791 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.605 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.1 OUTLIER -70.8 -38.9 73.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.594 0.235 . . . . 0.0 110.978 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . 0.478 ' HA ' ' HB1' ' B' ' 20' ' ' ALA . . . -59.08 -25.82 64.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.493 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.34 81.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.683 -179.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' B' ' 16' ' ' LYS . 4.9 pttp -77.62 -22.0 51.44 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.293 0.568 . . . . 0.0 110.865 174.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . 0.478 ' HB1' ' HA ' ' B' ' 17' ' ' ALA . . . -78.79 -19.48 52.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.54 -178.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . 0.411 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 25.4 t70 -69.18 -25.84 64.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.751 -175.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.663 ' HE3' HG23 ' B' ' 87' ' ' VAL . 12.4 ptm -117.49 179.87 3.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.814 0.34 . . . . 0.0 111.708 -177.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 34.8 t -76.61 113.64 15.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.527 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.04 112.67 21.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.896 -177.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . 0.489 HD22 ' HA ' ' B' ' 25' ' ' LEU . 4.1 mt -112.39 -169.09 1.41 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.02 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.69 144.65 47.11 Favored Pre-proline 0 C--N 1.317 -0.848 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 173.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.0 -25.14 11.92 Favored 'Trans proline' 0 CA--C 1.531 0.335 0 C-N-CA 123.554 2.836 . . . . 0.0 113.581 -176.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -43.22 59.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.969 0.414 . . . . 0.0 110.72 176.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.89 -32.97 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.95 178.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.429 ' HB3' HG23 ' B' ' 86' ' ' VAL . . . -66.69 -47.33 72.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.734 178.221 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' TYR . . . . . 0.616 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 71.5 t80 -67.92 -30.53 69.87 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.811 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -55.73 -53.1 60.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.946 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.563 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.2 OUTLIER -74.36 -27.05 60.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.813 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.681 HD12 ' HB2' ' B' ' 42' ' ' LEU . 2.9 mt -60.46 -55.9 27.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.024 0.44 . . . . 0.0 111.797 -178.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -76.03 -19.12 58.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.103 -0.499 . . . . 0.0 112.02 -173.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -16.72 18.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.486 -178.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.563 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 10.6 m-80 -121.32 101.24 44.22 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -66.2 -5.51 12.61 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 123.161 2.574 . . . . 0.0 113.416 -176.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.408 ' CG ' ' HZ3' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -98.28 -19.67 17.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.745 0.307 . . . . 0.0 110.84 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.62 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 26.5 mt -82.68 105.24 12.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.926 176.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.561 HG21 ' HB2' ' B' ' 61' ' ' ASN . 0.2 OUTLIER -98.72 145.18 27.17 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.05 -176.615 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.681 ' HB2' HD12 ' B' ' 34' ' ' LEU . 12.7 tp -100.91 125.18 47.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.755 HG12 ' HE2' ' B' ' 65' ' ' MET . 2.0 mt -105.55 115.57 47.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 175.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.75 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -101.26 133.66 45.5 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -126.78 98.96 5.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.599 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . 0.428 ' HG3' ' N ' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -160.16 154.93 24.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.314 -174.252 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.428 ' N ' ' HG3' ' B' ' 46' ' ' ARG . 0.0 OUTLIER -59.74 144.89 84.75 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 120.986 0.422 . . . . 0.0 111.241 -178.835 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.06 -18.54 35.55 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 123.322 2.681 . . . . 0.0 114.01 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.475 ' CB ' ' HB3' ' A' ' 50' ' ' GLU . 1.0 OUTLIER -74.89 -42.65 57.42 Favored 'General case' 0 CA--C 1.51 -0.568 0 O-C-N 121.867 -0.521 . . . . 0.0 111.296 -178.052 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -66.53 -35.09 79.39 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.777 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.4 mp -56.68 -34.17 67.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.417 176.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -79.31 -41.13 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.032 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.24 -48.06 13.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.476 -172.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -97.7 -34.32 10.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.755 0.312 . . . . 0.0 110.795 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 176.42 14.94 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.009 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' LYS . . . . . 0.777 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.1 OUTLIER -134.67 151.33 75.68 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.054 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -57.18 125.96 20.6 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.762 2.308 . . . . 0.0 112.671 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . 0.797 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 7.4 t0 -100.37 91.47 4.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.335 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . . . . . . . . . 2.8 m -128.49 166.39 25.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 176.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -29.14 67.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.824 0.345 . . . . 0.0 111.239 -176.177 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.561 ' HB2' HG21 ' B' ' 41' ' ' THR . 5.1 p30 -131.22 77.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.261 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' TYR . . . . . 0.75 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.6 OUTLIER -130.42 141.01 50.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.961 178.165 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.636 ' HE3' HD22 ' B' ' 79' ' ' LEU . 0.0 OUTLIER -135.31 135.41 40.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.86 0.362 . . . . 0.0 110.675 175.65 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -88.69 118.64 28.51 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' MET . . . . . 0.755 ' HE2' HG12 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -109.08 91.49 3.66 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.328 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.9 77.32 1.08 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.061 0.458 . . . . 0.0 111.609 -173.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' ARG . . . . . 0.822 ' HG2' ' HG2' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -105.5 -136.47 0.35 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.765 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -81.45 -44.11 8.13 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 119.145 -1.502 . . . . 0.0 109.68 169.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' LYS . . . . . 0.885 ' HA ' ' HE3' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -146.7 44.8 1.19 Allowed 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.553 -0.823 . . . . 0.0 108.996 171.001 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.557 HD13 HD11 ' B' ' 74' ' ' LEU . 0.5 OUTLIER 55.73 0.42 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.162 1.385 . . . . 0.0 114.432 177.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.682 ' HB2' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -45.94 -66.1 0.56 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -174.46 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . 0.822 ' HG2' ' HG2' ' B' ' 67' ' ' ARG . 55.3 Cg_endo -74.43 -15.13 22.42 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 121.99 1.794 . . . . 0.0 113.79 -177.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.489 HD21 ' HA ' ' B' ' 73' ' ' LEU . 0.1 OUTLIER -83.04 -15.11 52.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.218 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.557 HD11 HD13 ' B' ' 70' ' ' LEU . 9.0 tp -58.51 -53.84 53.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.975 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.09 -24.94 65.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.73 -25.98 49.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.745 -175.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' SER . . . . . 0.526 ' HB2' ' HE3' ' B' ' 65' ' ' MET . 1.4 m -106.31 43.99 1.09 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -173.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.75 77.77 0.09 OUTLIER Glycine 0 C--N 1.336 0.566 0 N-CA-C 114.495 0.558 . . . . 0.0 114.495 172.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.636 HD22 ' HE3' ' B' ' 63' ' ' LYS . 53.3 mt -127.59 136.19 51.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.711 0.255 . . . . 0.0 110.697 177.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.458 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 3.5 t0 -135.47 136.63 24.43 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.624 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' PRO . . . . . 0.581 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 32.9 Cg_exo -63.35 11.82 0.09 OUTLIER 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 123.542 2.828 . . . . 0.0 114.828 -173.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.95 -8.53 17.57 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 121.778 -0.576 . . . . 0.0 110.492 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' LYS . . . . . 0.436 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.8 mttp -90.93 134.18 30.75 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.751 -176.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.62 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 1.3 Cg_endo -78.6 121.82 5.28 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.756 2.304 . . . . 0.0 110.198 171.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.516 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.1 OUTLIER -127.23 151.68 34.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 120.959 0.409 . . . . 0.0 111.177 -174.876 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.501 HG11 HD11 ' B' ' 42' ' ' LEU . 1.4 p -125.18 140.19 48.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.013 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . 0.827 ' HB ' ' HB2' ' B' ' 95' ' ' ALA . 16.6 m -108.25 137.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.342 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.775 ' HZ ' ' HB2' ' B' ' 120' ' ' TRP . 8.3 t80 -120.19 143.9 47.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.575 -175.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 78.12 76.41 0.06 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.824 0.703 . . . . 0.0 111.31 -177.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.63 ' HA ' ' H ' ' B' ' 95' ' ' ALA . 0.3 OUTLIER -89.43 11.74 18.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.698 -179.275 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' THR . . . . . 0.652 HG23 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -98.62 -88.67 0.32 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -174.817 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.431 ' H ' ' HB ' ' B' ' 91' ' ' THR . . . -50.92 -72.65 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -175.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -75.28 -27.25 59.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.671 0.272 . . . . 0.0 110.488 178.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' ARG . . . . . 0.518 ' HD2' ' HG2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER 71.61 85.91 0.12 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.45 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.827 ' HB2' ' HB ' ' B' ' 87' ' ' VAL . . . -61.22 -12.89 14.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.995 179.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.05 -32.19 69.54 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.101 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -73.44 -26.94 61.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.858 0.361 . . . . 0.0 110.633 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' ALA . . . . . 0.509 ' HB3' HD23 ' B' ' 70' ' ' LEU . . . -73.65 -44.63 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.007 0.432 . . . . 0.0 110.691 178.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 99' ' ' GLY . . . . . 0.632 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -85.32 -45.46 5.86 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.637 -0.792 . . . . 0.0 114.061 -173.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 100' ' ' LYS . . . . . 0.476 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -64.71 -34.77 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.99 0.424 . . . . 0.0 111.19 -174.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 101' ' ' THR . . . . . 0.476 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 3.9 m -72.56 -35.43 67.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.179 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 102' ' ' LEU . . . . . 0.486 HD21 ' CE1' ' B' ' 107' ' ' PHE . 8.1 mt -67.04 -42.98 83.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -177.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 103' ' ' ARG . . . . . 0.743 ' HB3' HG23 ' B' ' 110' ' ' ILE . 0.0 OUTLIER -65.45 -26.59 68.02 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.08 0.467 . . . . 0.0 110.211 178.5 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.02 -7.38 48.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.701 177.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -108.21 -17.55 13.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.634 0.254 . . . . 0.0 110.876 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.73 29.05 1.46 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 119.987 -1.101 . . . . 0.0 113.351 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' PHE . . . . . 0.486 ' CE1' HD21 ' B' ' 102' ' ' LEU . 2.7 m-85 -74.36 154.97 38.62 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . 0.519 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -66.75 -92.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.065 0.459 . . . . 0.0 111.278 -174.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.519 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.2 OUTLIER -115.28 110.89 20.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.27 -178.935 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' ILE . . . . . 0.743 HG23 ' HB3' ' B' ' 103' ' ' ARG . 1.3 tt -112.23 128.58 68.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.035 0.445 . . . . 0.0 110.49 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -117.77 148.13 42.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.734 -174.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.4 ' HA ' HG21 ' B' ' 87' ' ' VAL . 11.8 t-20 -116.77 141.58 48.02 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 16.1 m -91.1 107.44 19.2 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -175.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.48 158.13 34.45 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.021 0.438 . . . . 0.0 110.748 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 90.74 -78.71 1.43 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.76 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . 0.481 ' HA3' ' S5 ' ' B' ' 139' ' ' PS5 . . . 142.27 -170.12 25.14 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.164 178.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 117' ' ' MET . . . . . 0.588 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 4.0 tpp -66.11 -30.28 70.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 110.32 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.562 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.28 -32.28 71.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.971 179.549 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 119' ' ' LYS . . . . . 0.427 ' HZ1' ' CG ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -69.64 -32.61 71.39 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.775 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 18.2 t-105 -60.23 -54.86 40.71 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.256 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.478 HD21 ' HA ' ' B' ' 121' ' ' LEU . 7.1 mt -66.95 -39.39 87.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.127 179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.562 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.9 OUTLIER -63.69 -43.41 96.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.799 -176.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . 0.459 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 3.1 tp10 -75.7 -2.95 31.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.25 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.35 30.4 60.6 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.799 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.459 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 52.2 mt -76.64 157.7 81.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . 0.51 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 25.2 Cg_endo -61.52 120.54 8.24 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.849 2.366 . . . . 0.0 112.25 -177.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.22 144.54 38.52 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 128' ' ' LEU . . . . . 0.797 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 19.8 mt -93.6 101.32 13.48 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 176.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.0 137.17 54.25 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.766 -176.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.75 78.16 4.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 174.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.5 m -36.31 120.11 0.64 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.154 -1.385 . . . . 0.0 112.606 -171.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -72.56 55.19 0.35 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.905 -173.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -89.38 44.79 1.23 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.09 0.472 . . . . 0.0 110.417 177.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -124.85 22.31 8.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.129 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -110.58 98.47 7.65 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.153 0.502 . . . . 0.0 110.357 177.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -78.33 -22.92 47.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.141 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 3.1 t60 . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.05 -0.976 . . . . 0.0 109.4 176.82 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 139' ' ' PS5 . . . . . 0.481 ' S5 ' ' HA3' ' B' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.666 0.27 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -151.88 5.55 0.43 Allowed 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -178.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.59 7.99 2.62 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.858 0.361 . . . . 0.0 111.668 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.783 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -50.45 -24.97 7.94 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.513 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.7 -31.91 68.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.901 0.381 . . . . 0.0 111.218 177.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -64.98 -57.24 9.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.098 -175.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.783 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.2 p90 -76.28 -21.23 56.53 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.391 -176.266 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.44 -49.81 63.85 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.348 0.405 . . . . 0.0 110.301 -178.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.81 85.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.458 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.5 -45.3 80.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.267 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CD2' HD23 ' B' ' 74' ' ' LEU . 0.9 OUTLIER -58.97 -47.28 85.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.147 0.498 . . . . 0.0 110.277 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.505 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -64.91 -26.64 68.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.289 178.024 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -41.89 61.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.0 0.428 . . . . 0.0 111.618 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -71.09 -49.82 40.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.625 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.3 t -63.01 -34.86 68.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.379 -177.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -68.86 -35.21 76.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.646 0.26 . . . . 0.0 111.25 178.524 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.99 -26.06 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.643 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.0 -35.66 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.489 ' HA ' ' SD ' ' A' ' 22' ' ' MET . 0.8 OUTLIER -74.64 -19.23 60.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.658 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.24 -24.81 59.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.474 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -87.47 17.86 4.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.915 0.388 . . . . 0.0 111.943 -175.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.52 ' HB3' ' HE1' ' A' ' 22' ' ' MET . 0.0 OUTLIER -144.79 165.2 28.76 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.121 -0.362 . . . . 0.0 111.462 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.1 t -84.03 104.51 12.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.544 174.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.629 ' HB3' ' HG2' ' A' ' 114' ' ' GLU . 0.7 OUTLIER -82.6 114.05 20.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.212 0.529 . . . . 0.0 110.85 -175.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.429 ' O ' ' HA ' ' A' ' 113' ' ' SER . 3.3 mt -122.98 147.05 47.07 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.252 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.6 142.9 78.1 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.177 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.697 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 4.9 Cg_endo -47.59 -31.05 13.31 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.551 2.834 . . . . 0.0 113.553 -178.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -74.05 -41.5 61.66 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 122.188 -0.32 . . . . 0.0 110.763 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -62.48 -37.44 85.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.233 175.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.403 ' HB3' HG22 ' A' ' 86' ' ' VAL . . . -71.13 -46.85 60.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.945 -179.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.599 ' HA ' HD13 ' A' ' 34' ' ' LEU . 88.0 t80 -66.67 -31.46 72.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.945 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -53.0 63.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.001 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.508 ' HB2' HD11 ' A' ' 40' ' ' ILE . 0.3 OUTLIER -71.03 -26.31 63.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.896 177.701 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.599 HD13 ' HA ' ' A' ' 31' ' ' TYR . 7.1 mt -60.14 -55.36 34.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.24 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.463 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 0.2 OUTLIER -73.49 -32.11 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.282 -176.974 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -77.33 -28.59 53.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.95 0.405 . . . . 0.0 111.077 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -125.85 100.7 30.51 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.736 -177.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.19 0.65 3.07 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.028 2.485 . . . . 0.0 112.887 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.68 -24.77 20.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.249 0.547 . . . . 0.0 109.814 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.687 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 55.8 mt -89.11 107.24 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.26 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.488 HG21 ' O ' ' A' ' 61' ' ' ASN . 0.3 OUTLIER -95.11 145.37 25.04 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.513 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.592 ' HB2' HD12 ' A' ' 34' ' ' LEU . 5.8 tp -103.36 130.04 50.56 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.709 HD12 HD12 ' A' ' 79' ' ' LEU . 92.3 mt -113.83 120.47 63.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.676 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.793 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -102.16 132.35 48.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -113.84 99.5 8.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.136 -178.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.625 ' HD2' ' OE2' ' A' ' 50' ' ' GLU . 3.9 mmt180 -156.51 -177.2 6.42 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.631 ' HB3' ' HD2' ' A' ' 48' ' ' PRO . 63.3 m-20 -111.35 168.98 6.8 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.631 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 55.9 Cg_endo -77.84 -23.44 9.44 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 121.863 1.709 . . . . 0.0 114.454 -168.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.69 -49.64 51.54 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.141 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.625 ' OE2' ' HD2' ' A' ' 46' ' ' ARG . 11.5 pm0 -70.25 -33.53 71.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.576 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.646 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.9 OUTLIER -62.73 -37.33 86.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.117 178.123 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -37.31 84.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.35 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.64 -50.56 10.47 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -172.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' MET . . . . . 0.455 ' HE2' ' HG2' ' A' ' 117' ' ' MET . 0.1 OUTLIER -100.3 -33.57 10.35 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.139 -174.004 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 176.47 14.56 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.799 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.646 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -143.89 158.42 56.05 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.4 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 15.6 Cg_endo -62.83 138.45 68.89 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 121.996 1.797 . . . . 0.0 112.589 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.4 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 3.6 t70 -112.41 94.05 4.74 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.686 177.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.461 HG13 ' CD1' ' A' ' 31' ' ' TYR . 2.0 m -131.95 162.61 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.303 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.463 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -55.17 -45.56 75.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.045 -176.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.488 ' O ' HG21 ' A' ' 41' ' ' THR . 14.0 p30 -122.56 73.48 1.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.76 0.79 . . . . 0.0 111.027 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.793 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.6 t80 -114.95 128.41 56.27 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.981 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.4 mtmt -120.46 121.44 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.807 0.337 . . . . 0.0 110.444 177.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.413 ' O ' ' HE2' ' A' ' 65' ' ' MET . 10.6 t-160 -90.14 116.17 27.94 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 176.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.806 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -110.94 93.54 4.54 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.831 -175.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.36 119.81 40.59 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.32 0.581 . . . . 0.0 112.026 -176.29 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.497 ' NE ' ' HA ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -155.81 -122.85 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 170.281 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.402 ' H ' ' HB3' ' A' ' 67' ' ' ARG . . . -77.01 -46.05 10.95 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 118.448 -1.834 . . . . 0.0 109.76 168.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.513 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -166.56 52.22 0.08 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.366 -0.417 . . . . 0.0 111.135 171.774 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.77 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 76.68 -8.32 1.69 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 172.629 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.716 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 0.4 OUTLIER -49.32 -64.84 1.0 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.041 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.716 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 11.4 Cg_exo -73.86 -17.26 22.83 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.205 1.937 . . . . 0.0 113.219 -176.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.806 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.6 OUTLIER -91.52 -29.01 17.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -173.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.874 HD13 HD11 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -62.42 -29.81 70.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.299 0.571 . . . . 0.0 111.411 -177.849 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.537 ' HB3' ' HB2' ' B' ' 8' ' ' ASP . . . -71.18 -32.75 69.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.697 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.82 -15.33 42.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -174.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -27.39 59.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 -176.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.1 61.07 0.86 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.601 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.874 HD11 HD13 ' A' ' 74' ' ' LEU . 11.1 mt -114.54 146.08 41.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.744 0.307 . . . . 0.0 110.688 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -136.71 150.23 69.43 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.419 176.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.65 17.01 0.47 Allowed 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 123.008 2.472 . . . . 0.0 113.667 -175.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.73 -1.28 19.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.155 0.503 . . . . 0.0 109.765 174.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 9.5 mmtm -100.06 128.73 30.03 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.047 -177.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.687 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 4.7 Cg_exo -74.83 122.17 7.11 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.565 2.177 . . . . 0.0 110.103 173.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.459 HG21 HD13 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -127.32 149.48 32.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 120.988 0.423 . . . . 0.0 111.132 -174.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.458 HG11 HD11 ' A' ' 42' ' ' LEU . 1.5 p -122.34 137.88 54.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.246 175.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.641 HG13 ' HB2' ' A' ' 98' ' ' ALA . 6.4 m -105.81 134.1 48.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.845 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 24.9 t80 -118.23 144.15 45.99 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.424 -173.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 81.96 72.16 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.766 0.826 . . . . 0.0 110.747 -175.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.872 ' HA ' ' H ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -93.75 1.73 56.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.871 -177.244 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.482 ' HB ' ' H ' ' A' ' 92' ' ' ALA . 0.0 OUTLIER -77.23 -102.45 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -175.049 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.549 ' HA ' ' O ' ' B' ' 68' ' ' GLY . . . -68.52 -43.5 76.62 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -174.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.409 ' HB1' ' S1 ' ' A' ' 138' ' ' PS5 . . . -73.13 -27.17 61.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.581 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 68.5 78.86 0.22 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.963 177.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.872 ' H ' ' HA ' ' A' ' 90' ' ' LYS . . . -64.75 -8.97 16.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.55 173.664 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.26 -36.72 76.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.556 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -70.44 -30.05 66.79 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.363 176.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . 0.641 ' HB2' HG13 ' A' ' 87' ' ' VAL . . . -75.83 -41.45 52.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.739 -177.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.48 ' HA2' HD12 ' A' ' 110' ' ' ILE . . . -93.63 -44.17 3.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.665 -171.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.26 -23.72 67.12 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.642 -0.328 . . . . 0.0 111.516 -174.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -54.24 14.81 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.131 0.491 . . . . 0.0 111.252 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.403 ' HA ' ' CD2' ' A' ' 105' ' ' TYR . 57.0 mt -56.27 -38.17 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.198 -172.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.601 ' HB3' HG23 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.05 -31.21 70.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.121 -179.567 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.86 -8.65 58.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.851 0.357 . . . . 0.0 110.938 176.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.61 ' HH ' ' HG3' ' B' ' 14' ' ' GLN . 16.7 m-30 -92.77 -38.28 11.88 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.09 50.94 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.476 -0.868 . . . . 0.0 112.583 174.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -92.92 159.73 15.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.617 0.246 . . . . 0.0 110.623 179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -69.02 0.39 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.466 -177.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.05 117.4 12.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.981 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.601 HG23 ' HB3' ' A' ' 103' ' ' ARG . 1.0 OUTLIER -119.16 128.84 75.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.217 0.532 . . . . 0.0 110.948 -179.578 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -119.27 152.28 36.96 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.544 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -121.98 148.48 44.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.442 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 5.8 m -89.11 113.47 24.63 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -174.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.629 ' HG2' ' HB3' ' A' ' 24' ' ' MET . 1.0 OUTLIER -64.45 143.45 57.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.623 177.646 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 96.0 -104.93 3.17 Favored Glycine 0 N--CA 1.443 -0.854 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 171.11 -165.07 38.19 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' MET . . . . . 0.569 ' HA ' ' CZ ' ' A' ' 88' ' ' PHE . 9.5 tpt -65.41 -29.48 70.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.036 178.038 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.582 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -61.71 -28.77 69.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.002 178.457 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.697 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -73.56 -33.01 64.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 111.447 0.165 . . . . 0.0 111.447 -178.929 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.845 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 18.8 t-105 -61.33 -54.54 42.59 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.828 0.347 . . . . 0.0 110.069 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.2 mt -62.89 -41.88 99.58 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.892 178.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.582 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.5 OUTLIER -65.33 -40.52 93.8 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.159 -177.007 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.584 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.7 tp10 -73.18 -4.89 35.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.918 0.39 . . . . 0.0 111.159 -177.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.49 27.33 63.63 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.771 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.584 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 97.1 mt -79.76 157.67 74.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 -178.646 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.406 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 20.6 Cg_endo -57.09 120.36 8.23 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 123.299 2.666 . . . . 0.0 112.209 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.47 151.77 50.6 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.483 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.4 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 0.8 OUTLIER -100.52 107.87 19.67 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 176.506 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.06 139.81 27.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.385 -175.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -83.82 87.69 7.09 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.958 178.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 m -40.33 113.77 0.39 Allowed 'General case' 0 C--O 1.235 0.299 0 O-C-N 124.03 0.831 . . . . 0.0 112.475 -176.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 25.5 m170 -79.69 83.77 5.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.589 -177.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -110.41 -12.66 14.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.83 0.348 . . . . 0.0 111.151 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -99.89 2.74 44.07 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.233 0.54 . . . . 0.0 110.081 177.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -84.24 63.11 7.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.527 176.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.25 -0.98 43.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.084 -177.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.705 -1.14 . . . . 0.0 109.095 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 121.089 0.471 . . . . 0.0 110.032 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -167.62 33.59 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.458 -175.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.75 0.05 40.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.107 -178.153 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . 0.751 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.67 -32.86 70.31 Favored Glycine 0 C--O 1.223 -0.541 0 CA-C-N 116.055 -0.52 . . . . 0.0 112.195 178.131 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.12 -31.61 62.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.059 0.457 . . . . 0.0 110.599 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -69.35 -57.19 5.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.076 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.751 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 3.8 p90 -72.56 -26.64 61.81 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.039 -0.664 . . . . 0.0 111.089 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . 0.537 ' HB2' ' HB3' ' A' ' 75' ' ' ALA . 0.3 OUTLIER -53.59 -42.78 67.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.556 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.07 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.995 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.82 -45.06 83.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.706 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' PHE . . . . . 0.589 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 0.1 OUTLIER -55.9 -46.94 78.23 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.307 0.575 . . . . 0.0 110.345 177.168 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' LYS . . . . . 0.641 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.24 -27.5 69.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.397 178.757 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.03 58.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.177 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . 0.61 ' HG3' ' HH ' ' A' ' 105' ' ' TYR . 10.6 mm-40 -70.96 -50.61 32.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.465 -179.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -33.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.949 -178.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.641 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -59.9 -39.36 85.09 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.573 0.225 . . . . 0.0 111.551 178.412 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.78 -26.39 68.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.977 0.418 . . . . 0.0 111.205 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.54 65.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.492 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -24.94 42.41 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.164 0.507 . . . . 0.0 111.128 173.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.61 -15.75 41.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.166 -173.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.98 -23.27 62.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -171.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.538 ' HE3' ' HB3' ' B' ' 100' ' ' LYS . 1.5 ptp -139.7 172.87 12.16 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.811 -177.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 22.9 t -67.27 109.55 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.553 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' MET . . . . . 0.461 ' HE1' ' HB3' ' B' ' 112' ' ' ASN . 0.4 OUTLIER -83.43 121.16 26.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.251 178.949 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.5 mt -129.5 141.63 50.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.9 -177.814 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.52 145.7 82.65 Favored Pre-proline 0 C--N 1.315 -0.934 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.503 ' HB3' ' HE3' ' B' ' 120' ' ' TRP . 1.3 Cg_endo -45.22 -29.74 4.57 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.01 3.14 . . . . 0.0 114.415 -175.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -44.84 49.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 111.143 177.048 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -29.9 68.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.472 178.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.35 -42.31 59.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.651 177.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' TYR . . . . . 0.481 ' CZ ' ' HG3' ' B' ' 126' ' ' PRO . 38.8 t80 -64.25 -40.59 96.33 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.036 0.446 . . . . 0.0 110.806 178.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . 0.43 ' O ' ' HB2' ' B' ' 36' ' ' GLU . 0.1 OUTLIER -50.3 -53.76 26.26 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.262 -177.421 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.583 HD11 HG23 ' B' ' 40' ' ' ILE . 0.3 OUTLIER -74.94 -27.57 60.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.268 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.464 HD23 ' HB2' ' B' ' 42' ' ' LEU . 3.2 mt -63.85 -57.52 9.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.146 0.498 . . . . 0.0 112.027 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.28 -18.28 55.49 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.047 -172.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' B' ' 32' ' ' LYS . 0.4 OUTLIER -98.2 -9.09 26.21 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.588 -176.537 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -133.76 106.74 11.72 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.818 0.342 . . . . 0.0 110.298 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -65.5 -2.73 6.57 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.23 2.62 . . . . 0.0 113.696 -176.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.54 -25.91 18.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.431 . . . . 0.0 110.115 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.583 HG23 HD11 ' B' ' 33' ' ' LEU . 9.1 mt -82.62 108.09 15.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.412 178.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.425 ' HA ' ' HB2' ' B' ' 61' ' ' ASN . 0.2 OUTLIER -101.57 144.83 29.84 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.093 -177.681 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.554 HD12 ' HB2' ' B' ' 88' ' ' PHE . 0.9 OUTLIER -103.96 127.96 51.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.923 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 2.0 mp -108.82 119.58 58.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 175.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.857 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -110.08 136.12 49.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.701 -178.73 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.09 100.05 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.88 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -153.88 152.93 31.2 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.964 -174.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -69.68 135.13 88.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.771 0.319 . . . . 0.0 110.566 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.01 -19.22 68.6 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.084 2.523 . . . . 0.0 113.851 -175.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.32 -40.08 37.75 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.825 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -67.57 -35.21 78.58 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.834 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.7 OUTLIER -60.27 -34.76 74.17 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.66 174.296 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -71.97 -41.74 67.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.834 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.99 -47.77 14.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.151 -172.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 12.4 mtt -102.36 -34.31 9.23 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.607 -173.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.94 178.28 15.45 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.821 176.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' LYS . . . . . 0.834 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 6.6 pttt -135.18 155.3 79.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.86 127.44 25.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.892 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . 0.67 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 26.5 t0 -101.99 81.68 2.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.272 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.499 HG21 ' HB2' ' B' ' 62' ' ' TYR . 0.9 OUTLIER -120.13 157.48 22.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.194 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -51.96 63.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.643 -175.136 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.425 ' HB2' ' HA ' ' B' ' 41' ' ' THR . 0.2 OUTLIER -109.82 80.65 1.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 0.0 110.545 -179.241 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' TYR . . . . . 0.857 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.5 t80 -121.32 130.56 53.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.046 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.535 ' HD2' ' HB3' ' B' ' 77' ' ' SER . 3.9 mttm -129.59 121.86 27.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.364 177.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -84.92 111.18 19.44 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' MET . . . . . 0.605 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.5 OUTLIER -109.34 98.05 7.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.729 0.299 . . . . 0.0 110.289 -177.719 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 2.6 m -117.85 120.67 38.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.186 0.517 . . . . 0.0 112.25 -173.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' B' ' 67' ' ' ARG . 0.0 OUTLIER -149.79 -131.46 0.05 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 172.247 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . 0.549 ' O ' ' HA ' ' A' ' 92' ' ' ALA . . . -86.97 -45.03 5.52 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 118.999 -1.572 . . . . 0.0 109.752 169.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' LYS . . . . . 0.435 ' HA ' ' HD3' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -143.99 43.3 1.45 Allowed 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 170.234 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.526 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.0 OUTLIER 60.64 -7.3 0.08 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 173.712 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.591 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -44.82 -58.23 5.74 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -172.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . 0.591 ' HD3' ' CD ' ' B' ' 71' ' ' GLU . 6.8 Cg_exo -73.52 -16.13 24.38 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.507 2.138 . . . . 0.0 112.818 -179.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.605 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -87.87 -19.68 27.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.458 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.64 HD22 HD23 ' B' ' 102' ' ' LEU . 24.2 tp -60.6 -51.42 69.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.701 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.85 -24.0 67.57 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.0 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.76 -22.05 50.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -177.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' SER . . . . . 0.564 ' HB2' ' HG ' ' B' ' 79' ' ' LEU . 0.3 OUTLIER -75.17 -39.65 60.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.803 0.335 . . . . 0.0 110.556 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.71 39.32 6.26 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.925 -177.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.564 ' HG ' ' HB2' ' B' ' 77' ' ' SER . 7.3 mt -83.2 151.75 25.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.602 0.239 . . . . 0.0 110.558 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.6 OUTLIER -125.48 133.72 25.13 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 37.4 Cg_exo -64.84 4.38 0.67 Allowed 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 123.502 2.801 . . . . 0.0 113.822 -176.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.37 -2.02 24.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.836 0.35 . . . . 0.0 110.799 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -109.74 146.03 33.21 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.94 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.573 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 7.9 Cg_exo -75.08 143.57 28.96 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 111.832 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.475 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.4 OUTLIER -143.74 147.43 19.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.759 -178.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.471 HG21 ' N ' ' B' ' 87' ' ' VAL . 2.3 p -124.78 139.63 50.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . 0.471 ' N ' HG21 ' B' ' 86' ' ' VAL . 4.4 m -109.28 124.31 65.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.094 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.825 ' HZ ' ' HB2' ' B' ' 120' ' ' TRP . 9.6 t80 -104.4 136.62 43.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.148 -171.667 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' B' ' 117' ' ' MET . 0.1 OUTLIER 87.68 66.85 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 O-C-N 124.291 0.995 . . . . 0.0 111.661 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -75.08 -21.48 58.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.54 178.75 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' THR . . . . . 0.486 ' HB ' ' H ' ' B' ' 92' ' ' ALA . 0.1 OUTLIER -73.47 -107.85 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.984 -173.302 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.486 ' H ' ' HB ' ' B' ' 91' ' ' THR . . . -55.24 -41.6 72.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.111 0.482 . . . . 0.0 112.198 -175.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.67 -27.93 60.63 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.09 -0.505 . . . . 0.0 112.018 -177.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' B' ' 94' ' ' ARG . 5.7 mmp_? 64.1 55.9 1.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.258 -179.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.85 -14.38 45.27 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.179 177.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' ALA . . . . . 0.544 ' HA ' HD22 ' B' ' 112' ' ' ASN . . . -54.77 -29.5 54.21 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.276 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -70.28 -32.04 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.888 0.375 . . . . 0.0 111.054 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.03 -44.26 55.0 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.01 0.433 . . . . 0.0 110.838 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 99' ' ' GLY . . . . . 0.556 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -80.45 -48.3 6.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.629 -0.796 . . . . 0.0 113.444 -175.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 100' ' ' LYS . . . . . 0.538 ' HB3' ' HE3' ' B' ' 22' ' ' MET . 0.0 OUTLIER -59.62 -42.74 93.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.809 0.337 . . . . 0.0 111.56 -172.748 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 101' ' ' THR . . . . . 0.446 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 0.7 OUTLIER -69.71 -35.34 74.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.461 -178.094 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 102' ' ' LEU . . . . . 0.64 HD23 HD22 ' B' ' 74' ' ' LEU . 9.2 mt -62.56 -50.42 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.554 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 103' ' ' ARG . . . . . 0.604 ' HB3' HG23 ' B' ' 110' ' ' ILE . 0.9 OUTLIER -65.98 -30.69 71.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.887 0.375 . . . . 0.0 110.597 -179.891 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.429 ' N ' ' HG3' ' B' ' 103' ' ' ARG . 7.2 mt-10 -71.24 -7.07 44.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.335 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -108.46 -11.51 15.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.746 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 129.74 14.73 2.05 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.017 -1.087 . . . . 0.0 113.89 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' PHE . . . . . 0.557 ' CE1' HD21 ' B' ' 102' ' ' LEU . 4.9 m-85 -70.97 140.23 50.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.399 0.599 . . . . 0.0 110.595 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.43 -81.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.784 -172.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.504 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -111.47 103.04 11.36 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.817 -176.213 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' ILE . . . . . 0.604 HG23 ' HB3' ' B' ' 103' ' ' ARG . 1.3 tt -114.47 131.1 67.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.472 0.653 . . . . 0.0 110.889 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -120.28 151.5 39.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.295 -178.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.544 HD22 ' HA ' ' B' ' 96' ' ' ALA . 4.6 t-20 -123.1 148.86 45.2 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.594 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 4.8 m -83.54 138.4 33.42 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.443 -177.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -97.39 152.99 18.38 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.117 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.98 -87.93 1.32 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.793 -176.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . 0.522 ' HA3' ' S5 ' ' B' ' 139' ' ' PS5 . . . 150.31 -166.81 30.13 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.033 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 117' ' ' MET . . . . . 0.494 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 7.7 tmm? -67.96 -33.01 73.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.991 0.424 . . . . 0.0 110.66 179.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.564 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -63.87 -29.63 70.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.634 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 119' ' ' LYS . . . . . 0.5 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -69.14 -33.56 73.63 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.868 -0.151 . . . . 0.0 111.368 177.872 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.825 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 34.8 t-105 -60.86 -53.56 55.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 9.5 mt -64.94 -39.73 93.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 178.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.564 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.3 OUTLIER -63.94 -34.62 78.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.716 -176.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . 0.539 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.7 OUTLIER -82.49 -0.85 48.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.939 0.399 . . . . 0.0 111.095 -178.576 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.26 29.38 68.55 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.143 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.539 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 77.6 mt -79.68 160.77 68.8 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . 0.612 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 21.9 Cg_endo -57.42 121.9 10.84 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 123.042 2.495 . . . . 0.0 112.152 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.56 151.14 52.02 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.436 -178.158 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 128' ' ' LEU . . . . . 0.67 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.1 mt -109.7 101.37 10.28 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.05 144.91 51.8 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -177.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 130' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' B' ' 130' ' ' ARG . 0.3 OUTLIER -88.48 82.16 7.01 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.482 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.1 m -42.41 116.22 0.81 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.962 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 132' ' ' HIS . . . . . 0.451 ' O ' ' HB2' ' B' ' 135' ' ' HIS . 66.8 m80 -81.04 64.75 5.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.859 -175.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -75.39 -12.41 60.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.979 0.419 . . . . 0.0 110.799 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -79.92 -4.54 52.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.071 175.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 135' ' ' HIS . . . . . 0.451 ' HB2' ' O ' ' B' ' 132' ' ' HIS . 0.1 OUTLIER -81.48 62.69 5.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.184 0.516 . . . . 0.0 110.667 179.236 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -73.06 -18.16 61.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.06 178.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.211 -0.9 . . . . 0.0 109.501 177.224 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' PS5 . . . . . 0.431 ' S3 ' ' HB3' ' A' ' 117' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 139' ' ' PS5 . . . . . 0.543 ' S5 ' ' HB3' ' B' ' 118' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.409 ' HA ' ' OD1' ' B' ' 80' ' ' ASP . . . . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.032 0.444 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -138.14 -5.06 1.67 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.052 -178.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.417 ' HG3' ' HB2' ' A' ' 6' ' ' LYS . 2.8 tpp -80.39 8.34 7.79 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.576 -178.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.584 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -55.99 -32.03 59.14 Favored Glycine 0 C--O 1.229 -0.192 0 CA-C-N 116.205 -0.452 . . . . 0.0 112.943 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.19 -33.08 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.75 0.31 . . . . 0.0 111.095 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.417 ' HB2' ' HG3' ' A' ' 3' ' ' MET . 20.1 mmtt -68.9 -58.04 4.69 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -172.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.584 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.6 OUTLIER -72.29 -34.05 67.89 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.468 -173.496 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.72 -57.35 11.17 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 123.309 0.381 . . . . 0.0 110.931 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.66 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . 0.522 HG23 ' CE1' ' B' ' 105' ' ' TYR . 1.3 m -67.15 -44.94 78.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.255 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.412 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.3 OUTLIER -54.16 -42.96 70.2 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.32 0.581 . . . . 0.0 109.908 178.485 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.545 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -65.94 -26.24 67.49 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.904 177.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.85 -45.66 49.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.852 0.358 . . . . 0.0 110.914 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -71.77 -50.47 29.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.96 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.548 HG12 ' HG2' ' B' ' 71' ' ' GLU . 0.8 OUTLIER -68.38 -34.19 64.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.464 -172.628 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.545 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -66.53 -27.74 68.0 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.222 -0.299 . . . . 0.0 111.157 -177.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.73 66.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.005 0.431 . . . . 0.0 111.187 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.24 70.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.023 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -23.94 49.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.313 0.578 . . . . 0.0 110.93 175.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.77 -20.68 27.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.977 -176.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -32.86 73.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.627 ' HE3' ' HA3' ' A' ' 99' ' ' GLY . 6.6 ptm -125.7 178.73 5.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.98 0.419 . . . . 0.0 111.924 -175.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.0 t -74.58 111.44 10.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.098 -178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.687 ' HE1' ' HB3' ' A' ' 112' ' ' ASN . 2.0 mmt -79.89 105.41 11.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.861 -178.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.419 ' HB2' ' HB3' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -113.11 139.63 48.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.096 0.474 . . . . 0.0 110.583 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.7 143.29 67.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.796 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -51.29 -24.33 15.4 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.632 2.888 . . . . 0.0 113.951 -176.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 mtmt -74.29 -43.87 55.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.071 0.462 . . . . 0.0 110.909 177.117 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.45 -29.13 62.35 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.566 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.61 -45.34 62.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.634 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.541 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 74.5 t80 -67.23 -32.02 72.78 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.997 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.8 tptt -56.29 -50.17 72.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.146 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 37' ' ' ASN . 0.3 OUTLIER -74.23 -27.53 60.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.678 177.648 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.688 HD12 ' HB2' ' A' ' 42' ' ' LEU . 2.5 mt -64.23 -48.27 76.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.027 0.441 . . . . 0.0 111.379 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -21.93 57.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.416 -175.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.98 -27.89 15.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 111.232 -177.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.499 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 5.9 m-80 -112.24 108.91 54.58 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.515 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -71.39 0.57 6.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 122.779 2.319 . . . . 0.0 112.037 177.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.72 -26.44 13.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.586 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.817 HG12 ' HG2' ' A' ' 84' ' ' PRO . 36.7 mt -80.66 113.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.73 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.79 144.06 31.98 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 -177.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.855 HD11 HG12 ' A' ' 86' ' ' VAL . 27.2 tp -96.56 121.41 38.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.441 HD12 HD12 ' A' ' 79' ' ' LEU . 88.2 mt -103.18 111.11 31.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.777 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -104.73 140.85 37.47 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.18 98.22 5.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.489 177.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.559 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -144.19 149.17 35.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.404 179.249 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.559 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 4.5 m-20 -67.67 141.17 94.88 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.039 -175.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -58.13 -25.75 72.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.546 2.831 . . . . 0.0 114.464 -169.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.21 -43.48 57.01 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.974 -0.69 . . . . 0.0 111.955 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -65.1 -35.37 80.9 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.857 176.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.655 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -57.38 -35.42 69.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.72 176.353 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.5 mtpt -79.61 -43.54 22.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.253 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -91.12 -48.07 7.17 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 mtm -95.56 -35.1 11.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.339 -174.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.69 171.03 12.9 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 113.641 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.655 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -142.49 162.35 45.12 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.471 ' HD3' ' HE1' ' A' ' 117' ' ' MET . 16.2 Cg_endo -62.83 132.44 37.3 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 121.934 1.756 . . . . 0.0 112.679 -176.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -107.37 77.41 1.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.068 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.47 HG23 ' HB2' ' A' ' 62' ' ' TYR . 3.0 m -119.3 166.78 13.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.6 -41.16 93.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.982 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 86.0 2.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.033 0.444 . . . . 0.0 111.036 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.777 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.0 OUTLIER -128.98 132.81 47.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.56 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.95 119.78 32.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.473 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -86.68 118.73 26.28 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 175.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.72 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -113.26 91.8 3.78 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.264 -174.713 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.54 139.31 36.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.056 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.849 ' HG2' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -176.97 -143.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 177.841 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.81 ' HA2' HG21 ' B' ' 91' ' ' THR . . . -79.59 -42.78 10.99 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 118.852 -1.642 . . . . 0.0 109.386 168.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.727 ' HE2' ' HG3' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -155.45 47.34 0.51 Allowed 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.558 -0.821 . . . . 0.0 110.075 171.418 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.72 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 64.99 -6.51 0.33 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 174.33 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.627 ' HB2' ' HE2' ' B' ' 12' ' ' LYS . 0.2 OUTLIER -44.05 -61.82 1.82 Allowed Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -172.952 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.849 ' HD2' ' HG2' ' A' ' 67' ' ' ARG . 7.6 Cg_exo -73.86 -15.85 23.59 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.448 2.098 . . . . 0.0 113.146 -178.038 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.568 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.1 OUTLIER -90.01 -19.08 24.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.908 0.385 . . . . 0.0 110.874 -177.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.601 HD12 HD23 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -73.14 -28.94 62.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.385 0.612 . . . . 0.0 110.43 -179.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.56 -28.28 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.958 173.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -18.06 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.943 -177.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -41.3 27.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.969 0.414 . . . . 0.0 110.281 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.85 55.34 1.15 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.395 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.441 HD12 HD12 ' A' ' 43' ' ' ILE . 10.9 mt -94.32 145.22 24.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.665 0.269 . . . . 0.0 110.493 -178.051 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -127.1 158.1 70.08 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.503 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 45.5 Cg_endo -70.93 9.16 0.84 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.89 2.393 . . . . 0.0 114.158 -174.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -1.9 11.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.824 0.345 . . . . 0.0 110.585 179.062 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.3 mmtm -88.53 134.6 33.89 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.29 -176.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.817 ' HG2' HG12 ' A' ' 40' ' ' ILE . 27.9 Cg_endo -88.29 124.31 1.7 Allowed 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.05 2.5 . . . . 0.0 111.261 175.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.618 HG22 HD13 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -135.35 149.92 28.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 111.205 -176.079 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.855 HG12 HD11 ' A' ' 42' ' ' LEU . 1.5 p -124.29 141.2 45.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.02 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.754 ' HB ' ' HB3' ' A' ' 95' ' ' ALA . 8.0 m -106.91 133.53 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.742 ' HZ ' ' HB2' ' A' ' 120' ' ' TRP . 14.4 t80 -116.97 137.2 52.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.935 -171.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' CYS . . . . . 0.457 ' SG ' ' HB2' ' A' ' 117' ' ' MET . 0.1 OUTLIER 84.24 101.43 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.407 1.067 . . . . 0.0 112.034 178.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.726 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -124.09 11.49 8.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.027 178.138 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.84 17.78 17.32 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -174.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -165.83 -72.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.089 0.471 . . . . 0.0 110.405 177.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.85 -27.44 63.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.313 177.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.727 ' HG3' ' HG2' ' B' ' 69' ' ' LYS . 1.3 mmt85 67.97 90.88 0.09 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.685 177.876 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.754 ' HB3' ' HB ' ' A' ' 87' ' ' VAL . . . -66.03 -9.06 27.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.242 177.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.456 ' HA ' ' ND2' ' A' ' 112' ' ' ASN . . . -58.64 -34.94 71.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.194 179.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -67.11 -30.41 70.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.866 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.52 -40.6 49.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.791 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.627 ' HA3' ' HE3' ' A' ' 22' ' ' MET . . . -96.86 -40.8 3.72 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.852 -171.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -25.02 67.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.847 0.356 . . . . 0.0 111.24 -174.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.59 -49.67 38.19 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.842 177.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.601 HD23 HD12 ' A' ' 74' ' ' LEU . 22.8 mt -57.79 -42.21 83.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.682 -174.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.459 ' HB3' HG23 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -68.68 -26.62 65.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.84 0.352 . . . . 0.0 110.742 178.314 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.71 -8.39 57.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.226 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.481 ' HH ' ' HA ' ' B' ' 11' ' ' PHE . 14.2 m-85 -105.26 -42.05 5.37 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 176.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 142.53 85.32 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.349 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 1.5 m-85 -126.44 156.75 40.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.605 0.24 . . . . 0.0 110.601 178.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -71.29 0.24 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.354 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.45 111.94 9.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.05 -177.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.618 HD13 HG22 ' A' ' 85' ' ' VAL . 1.5 tt -122.92 128.94 75.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.304 0.573 . . . . 0.0 111.062 -178.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.419 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 0.9 OUTLIER -117.52 149.84 39.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.501 -177.206 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.687 ' HB3' ' HE1' ' A' ' 24' ' ' MET . 8.1 t-20 -118.63 144.77 45.93 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.45 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 92.0 p -81.56 135.57 35.58 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.137 0.494 . . . . 0.0 111.95 -171.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.49 136.74 33.3 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.617 169.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 87.07 -127.13 8.28 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.271 -172.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -178.75 -159.96 23.98 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' MET . . . . . 0.471 ' HE1' ' HD3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -58.78 -33.79 70.71 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.401 . . . . 0.0 110.712 178.663 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.25 -34.37 72.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.962 178.465 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.434 ' HD2' ' OD1' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -73.93 -32.14 63.38 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.488 0.185 . . . . 0.0 111.174 -179.385 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.742 ' HB2' ' HZ ' ' A' ' 88' ' ' PHE . 18.6 t-105 -62.39 -54.28 42.58 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.432 ' HA ' HD22 ' A' ' 121' ' ' LEU . 2.2 mt -63.77 -42.4 97.78 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.7 0.286 . . . . 0.0 111.045 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 2.1 tt0 -62.1 -40.98 97.69 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.793 -177.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.532 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.8 OUTLIER -77.78 -0.72 28.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 69.12 29.67 72.14 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.925 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.532 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 75.2 mt -77.4 158.42 79.15 Favored Pre-proline 0 N--CA 1.45 -0.472 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.526 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 19.7 Cg_endo -55.31 114.41 1.86 Allowed 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 123.262 2.642 . . . . 0.0 112.129 -179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.78 152.9 51.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.073 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.0 mt -102.96 100.5 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.32 143.44 49.01 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.775 -178.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.37 114.73 27.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.55 -176.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.36 100.05 0.6 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.828 -179.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -79.48 66.87 5.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.516 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -86.41 1.04 52.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.435 -173.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -95.08 47.36 1.14 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.124 0.488 . . . . 0.0 110.173 177.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -120.42 41.89 3.12 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.471 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.5 -26.08 62.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.166 0.507 . . . . 0.0 109.661 177.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 2.7 t60 . . . . . 0 C--O 1.253 1.251 0 CA-C-O 117.784 -1.103 . . . . 0.0 108.515 177.533 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.004 0 CA-C-O 120.822 0.344 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -150.29 129.39 12.69 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.105 0.479 . . . . 0.0 110.316 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' MET . . . . . 0.503 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mpp? -94.53 3.22 55.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.587 -177.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . 0.581 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.85 -33.7 69.11 Favored Glycine 0 C--O 1.226 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.52 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -31.25 62.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.864 0.364 . . . . 0.0 111.143 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.428 ' HG3' ' HA ' ' B' ' 3' ' ' MET . 4.8 mmtt -72.29 -58.06 3.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.269 -172.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.581 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.1 p90 -73.69 -27.09 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.26 -175.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -47.12 69.38 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.425 0.453 . . . . 0.0 110.425 -177.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.9 -43.55 86.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.322 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -42.97 77.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.75 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' PHE . . . . . 0.584 ' CZ ' HD22 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -55.33 -48.76 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.307 0.575 . . . . 0.0 110.398 178.101 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' LYS . . . . . 0.627 ' HE2' ' HB2' ' A' ' 71' ' ' GLU . 1.8 tppt? -65.8 -26.05 67.52 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.94 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.19 -41.63 63.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.143 0.497 . . . . 0.0 111.061 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.55 -49.14 43.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.272 177.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . 0.465 HG12 ' HG2' ' A' ' 71' ' ' GLU . 1.2 t -64.45 -34.35 68.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.03 -174.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.569 ' HD2' ' HG3' ' B' ' 12' ' ' LYS . 0.2 OUTLIER -68.35 -38.9 81.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.692 0.282 . . . . 0.0 111.187 -178.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.27 -32.32 68.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.806 -177.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.81 73.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.141 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.43 -23.77 42.94 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.456 0.646 . . . . 0.0 110.803 173.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.67 -14.01 46.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.957 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -73.99 -20.39 60.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.115 -174.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.583 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 3.4 ptm -122.45 177.77 5.26 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.91 0.386 . . . . 0.0 111.503 -178.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.9 t -74.49 110.62 9.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.595 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.03 109.08 14.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.688 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . 0.492 HD21 ' HA ' ' B' ' 25' ' ' LEU . 2.7 mt -112.16 -168.76 1.36 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.052 0.453 . . . . 0.0 110.513 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 1.1 p -129.82 144.61 53.7 Favored Pre-proline 0 C--N 1.321 -0.67 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 7.9 Cg_endo -52.76 -17.18 6.82 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 123.34 2.693 . . . . 0.0 113.817 -176.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.431 ' HZ1' ' CD ' ' B' ' 123' ' ' GLU . 12.3 mtmm -73.05 -47.08 47.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.946 176.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.47 -33.22 42.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.725 178.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.528 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -64.21 -47.02 81.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.579 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' TYR . . . . . 0.461 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 39.0 t80 -66.92 -30.95 71.23 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.714 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -47.15 87.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.666 0.27 . . . . 0.0 111.32 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.549 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.3 OUTLIER -70.03 -26.57 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.088 -0.245 . . . . 0.0 110.991 178.934 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.683 HD12 ' HB2' ' B' ' 42' ' ' LEU . 51.7 mt -72.43 -45.36 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 110.705 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -73.59 -24.12 60.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.094 -174.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -105.13 -9.59 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.549 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 42.7 m-20 -129.47 111.18 17.8 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.731 0.3 . . . . 0.0 110.525 178.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -71.9 -1.63 10.25 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.155 2.57 . . . . 0.0 112.801 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -105.78 -26.31 11.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.542 -177.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.492 HG23 ' CD1' ' B' ' 33' ' ' LEU . 36.1 mt -77.53 110.58 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 175.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.433 HG23 ' HG3' ' B' ' 63' ' ' LYS . 1.1 m -100.64 144.67 29.34 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.791 -173.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.683 ' HB2' HD12 ' B' ' 34' ' ' LEU . 3.1 tp -104.85 125.31 50.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.42 HG22 ' HB2' ' B' ' 65' ' ' MET . 1.3 mp -104.34 114.05 42.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 175.221 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.819 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -102.8 133.9 47.08 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.446 -178.849 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . 0.488 ' O ' ' HG2' ' B' ' 46' ' ' ARG . 0.1 OUTLIER -122.13 97.86 5.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.547 -178.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . 0.572 ' HD2' ' S1 ' ' B' ' 139' ' ' PS5 . 0.0 OUTLIER -149.21 164.35 35.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.731 -178.54 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -71.55 137.01 83.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.668 0.271 . . . . 0.0 110.961 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.04 -26.68 58.02 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.688 2.258 . . . . 0.0 113.54 -177.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . 0.641 ' HA ' ' HD3' ' B' ' 52' ' ' LYS . 4.2 t0 -78.39 -33.25 48.94 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.233 176.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' GLU . . . . . 0.473 ' CD ' HH21 ' B' ' 46' ' ' ARG . 3.5 mt-10 -65.14 -34.76 79.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.073 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.854 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 mp -65.42 -35.12 79.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.432 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' LYS . . . . . 0.641 ' HD3' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -69.62 -39.97 76.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.436 178.324 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.11 -48.31 13.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 112.609 -173.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -97.52 -35.01 10.78 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.492 -172.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.12 172.72 14.93 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.91 -0.662 . . . . 0.0 111.794 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' LYS . . . . . 0.854 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 11.9 pttt -140.47 155.31 69.91 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.406 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 11.8 Cg_endo -59.02 124.26 15.29 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.51 2.14 . . . . 0.0 112.684 -177.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . 0.709 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 33.8 t0 -97.25 73.76 2.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.344 0.592 . . . . 0.0 110.486 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.572 HG23 ' HB2' ' B' ' 62' ' ' TYR . 2.8 m -113.31 171.26 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -30.07 55.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.979 0.419 . . . . 0.0 111.364 -174.818 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -122.55 65.23 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.649 -177.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' TYR . . . . . 0.819 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 1.2 t80 -114.85 125.29 53.5 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.477 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.433 ' HG3' HG23 ' B' ' 41' ' ' THR . 2.1 mttt -123.55 119.59 30.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' HIS . . . . . 0.475 ' O ' ' HE1' ' B' ' 65' ' ' MET . 2.2 t-160 -80.93 115.48 20.42 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' MET . . . . . 0.744 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER -113.34 91.24 3.58 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.443 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.99 88.59 2.96 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.049 0.452 . . . . 0.0 111.917 -173.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.0 -128.64 0.29 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 170.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -84.37 -43.72 6.87 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 109.305 -1.518 . . . . 0.0 109.305 168.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' LYS . . . . . 0.858 ' HA ' ' HE3' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -148.02 44.71 1.08 Allowed 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.45 -0.875 . . . . 0.0 109.439 170.449 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.693 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.1 OUTLIER 59.65 -2.58 0.13 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 175.476 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.625 ' HB2' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -45.39 -60.71 2.98 Favored Pre-proline 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.16 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . 0.625 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 11.8 Cg_exo -73.24 -16.09 25.16 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.576 2.184 . . . . 0.0 113.225 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . 0.744 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -85.53 -15.79 41.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.142 -175.805 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.44 ' HA ' HD11 ' B' ' 74' ' ' LEU . 9.5 tp -58.56 -49.19 78.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.262 0.553 . . . . 0.0 110.807 -179.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.32 -26.57 66.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.333 -179.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -74.43 -29.59 61.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.009 -175.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.54 -34.51 67.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 111.096 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.91 50.47 2.86 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.59 -0.815 . . . . 0.0 111.284 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 20.0 mt -97.23 148.42 23.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.778 0.323 . . . . 0.0 110.614 -178.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.448 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.5 OUTLIER -136.38 137.54 24.57 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.538 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 30.1 Cg_exo -67.23 24.17 0.11 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.416 2.744 . . . . 0.0 114.222 -174.244 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . 0.439 ' H ' ' C ' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -108.6 4.01 23.52 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.33 0.586 . . . . 0.0 109.793 174.986 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' LYS . . . . . 0.431 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.2 mttp -119.17 132.86 23.8 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.16 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.451 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 6.1 Cg_exo -69.62 143.01 50.15 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.453 2.102 . . . . 0.0 110.865 174.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.544 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 2.1 m -141.47 151.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -176.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.486 HG22 ' HB2' ' B' ' 111' ' ' TYR . 2.8 p -127.46 142.79 42.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 175.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . 0.789 ' HB ' ' HB3' ' B' ' 95' ' ' ALA . 18.6 m -104.93 157.9 5.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.675 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 4.4 t80 -122.99 111.4 16.56 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 4.5 t 87.29 99.43 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.171 1.389 . . . . 0.0 112.781 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.493 ' H ' ' HG3' ' B' ' 90' ' ' LYS . 0.0 OUTLIER -80.54 2.38 25.68 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.587 173.749 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' THR . . . . . 0.81 HG21 ' HA2' ' A' ' 68' ' ' GLY . 0.3 OUTLIER -95.06 158.28 15.53 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.829 -178.742 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . 58.31 -87.66 0.02 OUTLIER 'General case' 0 C--O 1.237 0.399 0 C-N-CA 123.285 0.634 . . . . 0.0 112.296 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' B' ' 94' ' ' ARG . . . -70.6 -27.62 64.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.65 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' ARG . . . . . 0.727 ' HG3' ' HE2' ' A' ' 69' ' ' LYS . 0.8 OUTLIER 69.99 84.78 0.14 Allowed 'General case' 0 C--O 1.232 0.182 0 O-C-N 124.014 0.821 . . . . 0.0 111.822 177.344 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . 0.789 ' HB3' ' HB ' ' B' ' 87' ' ' VAL . . . -66.22 -12.65 57.42 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.807 175.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.16 67.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 178.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' B' ' 97' ' ' LEU . 2.1 mm? -76.27 -28.07 56.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.271 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' ALA . . . . . 0.455 ' HB3' HD23 ' B' ' 70' ' ' LEU . . . -72.44 -30.94 65.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.321 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 99' ' ' GLY . . . . . 0.588 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -103.76 -46.22 1.42 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.727 -174.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 100' ' ' LYS . . . . . 0.416 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -62.46 -33.12 74.2 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.571 -0.37 . . . . 0.0 111.142 -174.832 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 101' ' ' THR . . . . . 0.416 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 1.2 m -73.46 -36.29 65.83 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.941 0.4 . . . . 0.0 111.061 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 102' ' ' LEU . . . . . 0.41 ' HA ' HD21 ' B' ' 102' ' ' LEU . 5.6 mt -67.78 -38.53 83.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.258 -176.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -26.13 67.25 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.917 0.389 . . . . 0.0 110.612 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.43 -5.58 50.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.273 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . 0.522 ' CE1' HG23 ' A' ' 10' ' ' THR . 22.0 m-30 -105.8 -8.14 17.93 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.078 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 123.73 5.05 7.81 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.012 -1.09 . . . . 0.0 113.734 171.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -69.4 130.54 42.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 117.034 0.417 . . . . 0.0 110.589 -179.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -57.58 -80.76 0.02 OUTLIER 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.087 -172.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.06 115.7 26.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.968 -177.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' ILE . . . . . 0.588 HD12 ' HA2' ' B' ' 99' ' ' GLY . 1.4 tt -118.92 127.37 75.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.604 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' TYR . . . . . 0.486 ' HB2' HG22 ' B' ' 86' ' ' VAL . 4.7 m-85 -113.39 144.5 42.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.387 -175.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.583 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 17.9 t-20 -117.62 143.41 46.16 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.146 -0.686 . . . . 0.0 109.146 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.588 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -83.06 134.32 35.03 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.633 -175.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.69 153.91 20.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.826 -1.079 . . . . 0.0 108.373 164.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . 0.574 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 82.9 -108.44 2.98 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 -173.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.15 -156.14 27.35 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.75 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 1.6 ttt -61.43 -35.21 76.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.961 0.41 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.519 ' HB3' ' S4 ' ' B' ' 139' ' ' PS5 . 0.2 OUTLIER -57.8 -38.57 75.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.639 177.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 119' ' ' LYS . . . . . 0.574 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -66.46 -33.21 75.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.805 -179.495 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.675 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 30.7 t-105 -59.99 -53.62 55.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . 0.435 HD21 ' HA ' ' B' ' 121' ' ' LEU . 12.8 mt -64.31 -39.69 94.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.861 177.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -61.59 -40.64 95.5 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.957 0.408 . . . . 0.0 111.369 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . 0.431 ' CD ' ' HZ1' ' B' ' 28' ' ' LYS . 73.9 mm-40 -74.05 -12.49 60.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.802 -179.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.2 56.98 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.572 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.473 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 83.7 mt -80.34 159.3 70.35 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.273 . . . . 0.0 110.607 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . 0.473 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 14.3 Cg_endo -54.57 119.36 6.29 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 123.09 2.526 . . . . 0.0 112.163 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.48 152.75 51.42 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.316 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 128' ' ' LEU . . . . . 0.709 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 3.2 mt -102.31 102.02 12.35 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.607 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.63 136.5 41.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.156 -175.394 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -89.11 78.92 7.31 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.7 m -45.16 123.93 4.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.831 -1.077 . . . . 0.0 112.725 -171.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 132' ' ' HIS . . . . . 0.559 ' HB3' ' HB2' ' B' ' 135' ' ' HIS . 45.3 m170 -82.52 69.47 9.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.042 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 37.7 t-80 -65.2 -37.06 86.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.586 -175.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -94.84 2.64 55.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 135' ' ' HIS . . . . . 0.559 ' HB2' ' HB3' ' B' ' 132' ' ' HIS . 1.1 t60 -79.58 65.71 4.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.02 0.438 . . . . 0.0 111.012 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -77.4 -31.12 53.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.903 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 117.926 -1.035 . . . . 0.0 109.184 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 139' ' ' PS5 . . . . . 0.572 ' S1 ' ' HD2' ' B' ' 46' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.924 0.392 . . . . 0.0 110.342 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.43 67.21 6.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.317 0.579 . . . . 0.0 110.015 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.4 ' HG3' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -95.86 19.02 12.04 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.563 -173.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.599 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -63.61 -52.27 47.4 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.041 178.689 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -59.75 -32.46 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.528 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.4 ' HG3' ' HG3' ' A' ' 3' ' ' MET . 13.1 mmtt -66.42 -57.51 7.24 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.055 -175.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.599 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.3 OUTLIER -84.28 -22.7 30.64 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -175.624 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.517 ' HB2' ' HB1' ' B' ' 75' ' ' ALA . 17.5 t70 -54.27 -41.94 69.41 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 111.023 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.83 -37.7 67.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.137 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -43.11 82.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.475 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.411 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.8 OUTLIER -58.18 -41.68 84.43 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.093 -179.309 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.573 ' HE2' ' HG3' ' B' ' 72' ' ' PRO . 12.2 tptp -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.164 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.97 -46.34 30.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.492 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -70.59 -51.86 25.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.798 -176.017 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.47 -34.32 50.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.898 0.38 . . . . 0.0 110.865 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.5 tptm -62.08 -36.08 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.395 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.62 -26.01 68.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.281 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.83 -31.91 71.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.656 176.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.57 ' HG2' ' HE3' ' A' ' 24' ' ' MET . 7.2 mtpp -75.86 -21.06 57.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.46 0.648 . . . . 0.0 110.819 173.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.46 46.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.279 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -75.64 -15.28 60.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.889 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.513 ' HB2' ' HE1' ' A' ' 22' ' ' MET . 1.5 mpp? -121.58 -179.45 4.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.965 0.412 . . . . 0.0 111.237 -177.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.5 t -88.22 105.81 15.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.61 175.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.796 ' HG3' ' HG2' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -73.45 100.04 3.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.856 0.36 . . . . 0.0 110.29 -177.627 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.473 HD21 ' HA ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -116.27 142.51 46.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.193 0.52 . . . . 0.0 111.127 -175.743 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.18 138.41 48.96 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.853 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.65 -14.46 3.28 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.697 2.932 . . . . 0.0 114.308 -176.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.42 -45.78 52.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.836 0.351 . . . . 0.0 110.795 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.0 OUTLIER -79.6 -33.34 41.64 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.544 176.175 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.52 93.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.453 179.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.475 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 63.5 t80 -74.19 -32.56 63.12 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -51.55 67.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.521 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -73.85 -27.54 61.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.72 0.295 . . . . 0.0 110.864 178.509 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.738 HD12 ' HB2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.55 -50.59 72.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.207 0.527 . . . . 0.0 110.838 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -27.5 56.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -76.75 -31.9 57.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.77 0.319 . . . . 0.0 111.067 -177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . 0.731 ' HB2' HG13 ' A' ' 40' ' ' ILE . 44.6 m-20 -119.73 114.42 34.15 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.842 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 15.6 Cg_exo -68.74 -0.27 5.86 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.197 2.598 . . . . 0.0 112.925 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -105.36 -18.48 14.1 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.193 179.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.799 HG12 ' HG2' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -74.27 114.37 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.615 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.509 ' HB ' HG13 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -107.64 140.04 41.26 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.793 -177.085 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.738 ' HB2' HD12 ' A' ' 34' ' ' LEU . 10.7 tp -103.93 120.92 42.04 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.736 HD12 HD23 ' A' ' 79' ' ' LEU . 1.3 mp -104.35 113.74 42.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.609 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 2.2 t70 -102.47 140.25 37.0 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.725 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -122.75 93.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.622 0.725 . . . . 0.0 109.777 173.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.55 ' HA ' HH21 ' A' ' 94' ' ' ARG . 11.9 mmm180 -143.27 152.64 41.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.415 178.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.94 142.07 64.29 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.498 -173.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -59.86 -25.28 78.92 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 123.37 2.714 . . . . 0.0 113.565 -172.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.81 -38.45 46.47 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.212 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.409 ' CD ' HH12 ' A' ' 46' ' ' ARG . 0.4 OUTLIER -72.91 -37.44 67.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 175.268 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.943 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.3 tp -59.35 -33.31 71.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.519 174.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -37.59 60.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.132 178.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.48 -49.66 13.02 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -174.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -100.11 -35.8 9.55 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.289 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.15 178.48 15.33 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.459 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.943 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -140.58 154.06 68.83 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.433 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.6 Cg_endo -61.38 123.27 12.46 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 121.976 1.784 . . . . 0.0 112.674 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.508 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 46.7 t0 -86.54 93.56 9.21 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 174.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.603 ' CG2' ' HB2' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -129.84 151.42 35.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.234 -177.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.87 76.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.172 0.51 . . . . 0.0 110.911 -178.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -116.95 66.84 0.72 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.356 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.609 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 12.2 t80 -108.38 122.52 47.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.611 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HD3' ' HB3' ' A' ' 77' ' ' SER . 18.9 mttm -122.83 109.31 14.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -93.11 114.53 27.07 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' MET . . . . . 0.524 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -102.55 171.28 7.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.841 0.353 . . . . 0.0 110.326 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' SER . . . . . 0.703 ' HA ' ' NH2' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -75.23 168.54 19.79 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 174.768 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.703 ' NH2' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -87.07 -47.29 9.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.006 0.432 . . . . 0.0 110.881 -176.082 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -100.63 -35.52 4.33 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.16 29.82 1.35 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.446 -0.377 . . . . 0.0 110.561 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.517 ' HG ' ' N ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -71.09 -41.38 70.71 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.402 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.517 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -47.31 -53.89 25.49 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.369 -175.626 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.484 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 73.9 Cg_endo -73.76 -16.73 23.44 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.076 1.851 . . . . 0.0 112.983 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.524 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -88.44 -15.74 34.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.671 0.272 . . . . 0.0 111.021 -177.809 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.616 HD22 HD22 ' A' ' 102' ' ' LEU . 6.3 tp -58.42 -53.49 57.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.176 0.512 . . . . 0.0 111.024 -178.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.47 -27.06 62.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.317 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.6 -28.79 62.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.84 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.473 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 41.2 m -77.41 -38.08 50.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.14 0.495 . . . . 0.0 109.957 178.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.24 81.25 1.58 Allowed Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.269 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.736 HD23 HD12 ' A' ' 43' ' ' ILE . 29.1 mt -122.36 148.64 44.82 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.466 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -128.06 138.93 34.0 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -70.54 -0.82 8.14 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 122.919 2.413 . . . . 0.0 114.266 -170.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.548 ' HA ' ' HG3' ' A' ' 108' ' ' LYS . 38.3 mm-40 -100.03 9.34 43.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.133 0.492 . . . . 0.0 109.997 175.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.466 ' HG3' ' OD2' ' A' ' 80' ' ' ASP . 7.2 mttm -102.82 128.11 28.58 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.235 -178.165 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.799 ' HG2' HG12 ' A' ' 40' ' ' ILE . 72.9 Cg_endo -72.96 122.06 7.81 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.409 2.072 . . . . 0.0 110.806 174.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.509 HG13 ' HB ' ' A' ' 41' ' ' THR . 1.8 m -130.56 152.62 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.029 0.443 . . . . 0.0 111.371 -173.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.588 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 1.2 p -127.07 142.49 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 16.4 m -104.33 135.82 40.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.124 0.488 . . . . 0.0 110.556 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.686 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.9 t80 -119.48 144.65 46.88 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.753 -177.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' CYS . . . . . 0.585 ' HB3' ' HB1' ' A' ' 95' ' ' ALA . 52.7 t 176.73 -73.97 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.446 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.692 ' HA ' ' HA3' ' A' ' 116' ' ' GLY . 0.6 OUTLIER -162.46 -149.91 0.16 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.423 175.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' THR . . . . . 0.618 ' H ' ' HD3' ' A' ' 90' ' ' LYS . 0.2 OUTLIER -109.02 28.06 8.87 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -174.037 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -127.32 -177.1 3.94 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -175.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -60.04 -26.52 66.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.956 -1.02 . . . . 0.0 112.667 -176.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 0.575 ' HB3' ' S1 ' ' A' ' 138' ' ' PS5 . 1.7 ttt180 -49.47 -46.71 48.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.636 0.255 . . . . 0.0 111.618 -177.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.585 ' HB1' ' HB3' ' A' ' 89' ' ' CYS . . . -77.13 -35.41 56.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.117 0.484 . . . . 0.0 110.627 176.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.71 -27.91 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.174 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -67.59 -35.27 78.67 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.407 179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.73 -45.63 50.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.913 0.387 . . . . 0.0 110.427 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.447 ' HA2' HD12 ' A' ' 110' ' ' ILE . . . -70.21 -53.45 13.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.57 -177.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.512 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -62.3 -35.81 80.19 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.704 -0.292 . . . . 0.0 111.408 -174.245 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.512 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 23.4 m -70.75 -35.57 72.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.826 0.346 . . . . 0.0 110.8 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.616 HD22 HD22 ' A' ' 74' ' ' LEU . 13.1 mt -66.36 -47.77 72.35 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.84 0.352 . . . . 0.0 111.083 177.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.613 ' HB3' HG23 ' A' ' 110' ' ' ILE . 0.6 OUTLIER -67.79 -26.17 65.96 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.966 0.413 . . . . 0.0 110.356 178.535 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -8.08 32.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.395 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -108.81 -12.03 14.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.576 0.226 . . . . 0.0 111.385 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.58 18.5 4.83 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.072 -1.061 . . . . 0.0 113.343 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -66.2 140.16 58.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.548 ' HG3' ' HA ' ' A' ' 82' ' ' GLU . 14.5 mtpp -62.69 -84.69 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.194 -171.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.39 109.85 19.36 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.686 -177.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.613 HG23 ' HB3' ' A' ' 103' ' ' ARG . 1.3 tt -114.71 128.74 71.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.154 0.502 . . . . 0.0 111.247 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.588 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 12.0 m-85 -113.36 139.67 48.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.433 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -115.98 144.41 44.11 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.05 130.12 34.87 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.867 -173.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.796 ' HG2' ' HG3' ' A' ' 24' ' ' MET . 0.0 OUTLIER -96.09 17.29 15.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.374 172.777 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.46 -70.63 0.12 Allowed Glycine 0 N--CA 1.442 -0.944 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.836 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.692 ' HA3' ' HA ' ' A' ' 90' ' ' LYS . . . 114.59 177.71 18.96 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.08 179.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' MET . . . . . 0.546 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -57.73 -37.98 74.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.822 0.344 . . . . 0.0 111.11 -178.199 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.53 -28.52 70.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.505 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -75.38 -31.95 60.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.37 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.686 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -57.24 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.445 ' HG ' ' HE3' ' A' ' 117' ' ' MET . 62.4 mt -63.21 -37.4 87.08 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.555 175.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -60.23 -40.09 89.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.718 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.487 ' HB2' ' HG ' ' A' ' 125' ' ' LEU . 38.6 mm-40 -81.89 -3.08 53.3 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.251 -177.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.98 32.46 73.33 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.584 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 76.6 mt -78.82 163.26 61.58 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.359 -178.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.584 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 28.2 Cg_endo -57.53 113.26 1.42 Allowed 'Trans proline' 0 CA--C 1.517 -0.338 0 C-N-CA 122.824 2.35 . . . . 0.0 111.484 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.9 m -121.09 151.07 40.28 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . 0.756 ' HB3' ' HE2' ' A' ' 56' ' ' LYS . 1.3 mt -98.92 101.35 12.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.838 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -122.41 144.77 48.83 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.67 103.24 0.09 Allowed 'General case' 0 C--N 1.328 -0.335 0 O-C-N 123.429 0.455 . . . . 0.0 109.858 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.41 129.69 36.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.951 -169.094 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -79.4 84.52 5.29 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.749 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.78 170.26 22.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.241 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -81.19 66.75 6.85 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -133.42 111.96 11.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.683 -172.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -84.92 170.33 13.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.397 177.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.439 -0.791 . . . . 0.0 109.967 177.973 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 120.922 0.391 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -86.6 76.58 9.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.101 0.477 . . . . 0.0 110.429 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 1.6 ttm -92.67 19.57 7.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.316 -176.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . 0.701 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -55.13 -34.96 59.02 Favored Glycine 0 C--O 1.227 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.427 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.58 -32.24 71.34 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 122.946 0.498 . . . . 0.0 111.628 176.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -72.79 -57.93 3.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.133 -174.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.701 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.3 p90 -74.75 -25.66 59.24 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.521 -176.417 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -53.71 -52.47 59.96 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 123.361 0.413 . . . . 0.0 110.553 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.81 -44.3 77.64 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.84 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' THR . . . . . 0.427 ' O ' ' HB1' ' B' ' 13' ' ' ALA . 0.5 OUTLIER -66.74 -42.29 86.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -175.658 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' PHE . . . . . 0.41 ' CE1' HD22 ' A' ' 70' ' ' LEU . 0.6 OUTLIER -53.5 -43.81 68.54 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.221 0.534 . . . . 0.0 110.704 -178.699 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' LYS . . . . . 0.464 ' HZ1' ' CD ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -67.38 -24.58 65.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.258 177.72 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . 0.427 ' HB1' ' O ' ' B' ' 10' ' ' THR . . . -72.66 -48.78 36.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.866 0.365 . . . . 0.0 110.81 176.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -67.69 -51.41 49.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.303 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.69 -34.1 41.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.935 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . 0.441 ' HB3' ' HE2' ' B' ' 16' ' ' LYS . 5.9 mtpt -66.63 -39.43 88.27 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.741 0.305 . . . . 0.0 111.16 176.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.93 -26.89 68.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.573 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.45 -33.3 64.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.116 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.64 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 0.1 OUTLIER -75.94 -21.25 57.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.125 0.488 . . . . 0.0 110.928 174.874 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.96 -19.16 61.94 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.026 -174.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.5 -1.18 57.62 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -176.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.629 ' HG3' HG21 ' B' ' 110' ' ' ILE . 1.5 mpp? -120.47 165.93 14.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.83 0.348 . . . . 0.0 111.343 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 15.4 t -80.99 103.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' MET . . . . . 0.781 ' HE1' ' HB3' ' B' ' 112' ' ' ASN . 0.5 OUTLIER -79.14 107.21 11.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.997 0.427 . . . . 0.0 110.672 -174.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . 0.499 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.1 mt -126.73 142.08 51.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.662 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.48 151.8 85.33 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.203 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.421 ' HB2' ' CD1' ' B' ' 125' ' ' LEU . 4.7 Cg_endo -47.66 -31.33 14.14 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.854 3.036 . . . . 0.0 114.372 -177.176 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . 0.844 ' HD3' ' HG2' ' B' ' 123' ' ' GLU . 1.3 mtmm -74.43 -42.67 58.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.471 . . . . 0.0 110.791 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.94 -32.44 69.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.117 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.26 -44.05 69.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.464 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' TYR . . . . . 0.57 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.3 t80 -67.03 -30.47 70.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.204 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -57.09 -52.85 63.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.035 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.555 ' HB2' HD13 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -73.9 -27.75 61.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.677 178.321 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.57 ' HB2' ' HA ' ' B' ' 31' ' ' TYR . 1.1 mt -61.73 -55.8 26.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.945 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.06 -22.19 55.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.775 -173.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.84 -31.78 20.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.964 0.411 . . . . 0.0 110.555 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . 0.413 ' C ' ' H ' ' B' ' 39' ' ' ASP . 43.3 m-80 -121.3 102.94 42.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.437 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . 0.485 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 17.1 Cg_exo -68.27 5.81 1.08 Allowed 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.261 2.641 . . . . 0.0 112.545 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . 0.413 ' H ' ' C ' ' B' ' 37' ' ' ASN . 0.4 OUTLIER -91.83 -27.56 17.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.583 174.573 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.555 HD13 ' HB2' ' B' ' 33' ' ' LEU . 9.2 mt -82.37 109.2 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.688 175.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.2 m -100.25 145.22 28.35 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.672 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.539 HD11 HG12 ' B' ' 86' ' ' VAL . 12.2 tp -101.1 122.58 43.84 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.404 ' O ' ' HA ' ' B' ' 87' ' ' VAL . 79.7 mt -103.85 111.16 32.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.213 176.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.819 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -98.96 129.43 45.27 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.68 96.64 4.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.366 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . 0.546 ' HG2' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -155.75 167.0 31.82 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.369 -177.464 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.433 ' H ' ' HD2' ' B' ' 46' ' ' ARG . 0.7 OUTLIER -75.6 125.66 88.31 Favored Pre-proline 0 C--N 1.314 -0.941 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.125 -176.439 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -65.43 -19.79 61.22 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.901 2.401 . . . . 0.0 113.472 -172.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.66 -46.15 73.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.975 0.417 . . . . 0.0 110.472 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.05 -34.07 66.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.582 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.837 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.5 OUTLIER -58.87 -45.77 89.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.467 0.651 . . . . 0.0 110.253 176.597 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -66.53 -37.01 84.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.4 -48.41 10.38 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -174.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.1 -35.79 11.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.932 -172.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 135.64 159.36 8.53 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.125 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' LYS . . . . . 0.837 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -139.49 154.99 72.04 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.06 123.23 13.36 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.278 1.986 . . . . 0.0 112.562 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -101.83 74.99 1.51 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.2 0.524 . . . . 0.0 109.954 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.42 HG13 ' CE1' ' B' ' 31' ' ' TYR . 3.1 m -115.95 167.92 8.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.837 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -41.53 99.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.942 -175.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.485 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 0.0 OUTLIER -122.49 77.34 1.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.362 0.601 . . . . 0.0 110.857 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' TYR . . . . . 0.819 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.2 t80 -122.57 127.8 49.91 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.749 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 11.2 mttt -123.29 124.57 43.27 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.876 176.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -88.11 128.34 35.42 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -112.3 162.58 15.36 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 173.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' SER . . . . . 0.44 ' O ' ' HB3' ' B' ' 70' ' ' LEU . 0.9 OUTLIER -79.17 140.77 37.66 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' ARG . . . . . 0.437 ' H ' ' HG3' ' B' ' 67' ' ' ARG . 0.0 OUTLIER -48.72 -48.42 40.44 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.628 -173.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . 0.494 ' HA3' ' S3 ' ' A' ' 138' ' ' PS5 . . . -104.05 -44.53 1.61 Allowed Glycine 0 N--CA 1.44 -1.04 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.021 176.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' LYS . . . . . 0.569 ' O ' ' HD2' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -82.45 35.73 0.46 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.327 -0.436 . . . . 0.0 111.669 -175.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.44 ' HB3' ' O ' ' B' ' 66' ' ' SER . 0.1 OUTLIER -74.66 -25.26 59.07 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 173.519 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.478 ' H ' ' HG3' ' B' ' 71' ' ' GLU . 0.0 OUTLIER -50.24 -59.47 7.06 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.399 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . 0.573 ' HG3' ' HE2' ' A' ' 12' ' ' LYS . 3.9 Cg_exo -74.43 -15.85 22.04 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.605 2.203 . . . . 0.0 112.965 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -87.19 -6.22 58.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.607 0.242 . . . . 0.0 111.504 -174.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.491 HD22 ' CD1' ' A' ' 7' ' ' PHE . 6.0 tp -63.98 -54.87 27.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.555 -175.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.517 ' HB1' ' HB2' ' A' ' 8' ' ' ASP . . . -69.73 -23.62 63.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.891 0.377 . . . . 0.0 111.399 -179.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.91 -31.21 61.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.796 -177.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -73.93 -39.26 63.92 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.13 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.55 81.2 1.46 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.908 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.5 mt -123.45 142.54 50.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.657 0.265 . . . . 0.0 110.93 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.496 ' OD2' ' HG2' ' B' ' 83' ' ' LYS . 0.0 OUTLIER -114.77 136.28 22.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.24 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.49 -0.37 2.93 Favored 'Trans proline' 0 N--CA 1.476 0.468 0 C-N-CA 123.078 2.519 . . . . 0.0 114.234 -172.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . 0.44 ' HB2' ' OD2' ' B' ' 80' ' ' ASP . 3.6 mm-40 -98.73 -11.59 21.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 0.0 110.717 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' LYS . . . . . 0.496 ' HG2' ' OD2' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -82.85 122.01 77.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.626 179.028 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.543 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 15.9 Cg_exo -63.94 132.7 35.6 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.363 2.042 . . . . 0.0 110.168 173.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.648 HG22 HD13 ' B' ' 110' ' ' ILE . 0.0 OUTLIER -131.58 143.01 41.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 120.893 0.378 . . . . 0.0 111.124 -173.414 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.539 HG12 HD11 ' B' ' 42' ' ' LEU . 0.7 OUTLIER -121.85 139.78 47.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 175.508 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' B' ' 43' ' ' ILE . 1.3 m -102.8 126.46 57.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.074 0.464 . . . . 0.0 110.33 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.677 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 3.2 t80 -111.88 140.27 46.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.371 -174.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . 0.546 ' SG ' ' HG2' ' B' ' 46' ' ' ARG . 49.6 t 170.34 -63.92 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.866 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.535 ' HA ' ' HA2' ' B' ' 116' ' ' GLY . 0.1 OUTLIER -172.36 -167.76 0.49 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.261 -0.882 . . . . 0.0 109.173 175.708 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -36.79 60.15 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -175.233 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.6 -167.44 0.68 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -168.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -56.95 -26.77 60.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 114.047 -1.433 . . . . 0.0 113.645 -172.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' ARG . . . . . 0.401 ' HG2' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -48.39 -55.0 11.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.749 0.309 . . . . 0.0 111.365 -176.381 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -77.9 -33.94 51.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.947 177.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.36 72.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.111 -176.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.78 -39.59 84.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.799 0.333 . . . . 0.0 110.93 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.99 -45.57 70.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.0 0.429 . . . . 0.0 110.237 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 99' ' ' GLY . . . . . 0.575 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -69.21 -50.47 33.17 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.54 -178.136 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 100' ' ' LYS . . . . . 0.601 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -60.96 -38.35 85.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -173.943 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 101' ' ' THR . . . . . 0.601 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 2.3 m -72.84 -35.91 67.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.614 0.245 . . . . 0.0 111.06 178.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 10.1 mt -62.94 -47.82 81.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.515 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 103' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -65.09 -26.75 68.36 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.906 0.384 . . . . 0.0 110.53 179.209 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . 0.42 ' CD ' ' HZ3' ' B' ' 100' ' ' LYS . 13.8 mt-10 -69.36 -7.45 37.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.828 177.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . 0.411 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 23.5 m-85 -103.36 -8.24 20.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 0.0 110.938 178.281 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.14 41.4 1.53 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.243 -0.979 . . . . 0.0 112.735 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -87.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.418 -175.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.17 119.62 35.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.879 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' ILE . . . . . 0.648 HD13 HG22 ' B' ' 85' ' ' VAL . 1.2 tt -119.46 126.58 75.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.252 0.549 . . . . 0.0 110.818 -176.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' TYR . . . . . 0.533 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 3.1 m-85 -112.95 141.67 46.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.866 -174.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . 0.781 ' HB3' ' HE1' ' B' ' 24' ' ' MET . 0.7 OUTLIER -112.26 139.51 47.74 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.301 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' SER . . . . . 0.499 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 0.3 OUTLIER -81.93 119.86 24.48 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -173.266 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . 0.554 ' CG ' ' HB3' ' B' ' 24' ' ' MET . 2.4 mm-40 -82.08 5.19 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.79 177.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -107.99 -99.06 2.59 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.012 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . 0.535 ' HA2' ' HA ' ' B' ' 90' ' ' LYS . . . 155.18 166.74 15.82 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 -178.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 117' ' ' MET . . . . . 0.459 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.1 OUTLIER -59.75 -39.19 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.006 0.431 . . . . 0.0 110.75 -178.208 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 18.6 p-10 -68.78 -23.85 64.35 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.83 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 119' ' ' LYS . . . . . 0.477 ' HD2' ' HA ' ' B' ' 119' ' ' LYS . 0.1 OUTLIER -73.67 -32.14 63.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.883 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.677 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 27.7 t-105 -58.83 -51.46 69.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.736 177.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 11.5 mt -67.3 -40.12 86.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.144 178.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.2 OUTLIER -63.7 -45.93 87.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.665 -176.706 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . 0.844 ' HG2' ' HD3' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -83.69 17.05 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.646 -176.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 67.44 23.05 73.46 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.007 171.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.439 HD11 ' CD2' ' B' ' 120' ' ' TRP . 53.3 mt -75.29 154.54 86.15 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 117.101 0.451 . . . . 0.0 110.347 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -58.65 115.75 2.77 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.046 2.497 . . . . 0.0 112.219 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.17 150.59 52.0 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.181 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 128' ' ' LEU . . . . . 0.435 ' HB2' ' HG2' ' B' ' 56' ' ' LYS . 2.5 mt -83.31 101.07 11.05 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -121.17 123.61 42.69 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -86.53 79.59 8.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.965 0.412 . . . . 0.0 110.707 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.17 173.03 9.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.284 175.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -80.27 54.1 1.92 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.234 0.54 . . . . 0.0 111.119 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -94.93 126.55 40.34 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.939 174.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.23 103.12 0.45 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -143.69 110.32 5.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.625 -173.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -65.61 114.99 5.34 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.521 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.036 -0.983 . . . . 0.0 109.202 177.257 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' PS5 . . . . . 0.575 ' S1 ' ' HB3' ' A' ' 94' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 139' ' ' PS5 . . . . . 0.56 ' S4 ' ' HB2' ' A' ' 67' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.456 ' HA ' ' OD1' ' B' ' 80' ' ' ASP . . . . . . . . 0 N--CA 1.482 1.166 0 CA-C-O 120.718 0.294 . . . . 0.0 111.229 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.84 67.08 8.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.281 0.562 . . . . 0.0 111.352 -178.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.554 ' HG3' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -113.88 10.07 17.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.331 178.72 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.541 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -62.69 -39.8 98.38 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.783 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -65.03 -32.88 74.82 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.266 0.555 . . . . 0.0 110.289 176.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.554 ' HG3' ' HG3' ' A' ' 3' ' ' MET . 17.0 mmtt -64.78 -57.5 8.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 112.252 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.541 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.8 p90 -80.43 -26.65 38.29 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 119.788 -0.765 . . . . 0.0 112.065 -174.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . 0.451 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . 16.0 t70 -53.85 -51.18 64.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.959 0.409 . . . . 0.0 111.176 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.388 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -68.57 -40.62 80.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.932 -175.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . 0.411 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.5 OUTLIER -57.86 -45.96 85.54 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.194 0.521 . . . . 0.0 110.293 -178.402 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.544 ' HD3' ' HG3' ' B' ' 72' ' ' PRO . 1.2 tptp -65.31 -24.98 67.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.083 175.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.18 -44.54 46.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.227 178.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -71.51 -51.3 24.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.613 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.619 HG11 ' HB3' ' A' ' 93' ' ' ALA . 2.3 t -57.24 -33.63 43.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.979 0.419 . . . . 0.0 110.869 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -37.4 70.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.356 177.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.35 -26.04 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.028 0.442 . . . . 0.0 111.551 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.04 -31.63 66.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.06 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.466 ' HD2' ' HE1' ' A' ' 24' ' ' MET . 32.2 mtmt -76.14 -22.43 55.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.42 0.628 . . . . 0.0 110.579 173.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.15 58.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.865 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -76.85 -9.12 58.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.886 -176.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.445 ' HE1' ' HB2' ' A' ' 22' ' ' MET . 0.7 OUTLIER -127.98 171.6 11.69 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.128 -0.357 . . . . 0.0 111.299 -177.363 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -84.49 109.66 18.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' MET . . . . . 0.842 ' HE2' ' HG2' ' A' ' 114' ' ' GLU . 0.6 OUTLIER -78.02 103.47 7.98 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.7 -174.739 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.583 ' O ' ' HA ' ' A' ' 113' ' ' SER . 7.5 mt -121.1 140.89 51.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.157 0.503 . . . . 0.0 111.316 -177.165 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 141.77 76.15 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.052 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -44.51 -30.12 3.7 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 124.203 3.269 . . . . 0.0 114.636 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.451 ' HG2' ' OE2' ' A' ' 123' ' ' GLU . 0.4 OUTLIER -73.65 -42.59 61.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.941 0.4 . . . . 0.0 111.142 178.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.38 -33.25 69.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.212 177.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.421 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -65.98 -47.46 74.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.082 176.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TYR . . . . . 0.632 ' HA ' HD11 ' A' ' 34' ' ' LEU . 51.6 t80 -64.2 -30.53 71.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.076 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -52.61 64.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.022 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.509 ' HB2' HD11 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -73.73 -27.42 61.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.886 178.758 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.632 HD11 ' HA ' ' A' ' 31' ' ' TYR . 35.2 mt -62.32 -54.65 37.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.302 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLN . . . . . 0.449 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -76.39 -28.03 56.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.04 -174.348 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.449 ' N ' ' HG3' ' A' ' 35' ' ' GLN . 17.7 mt-10 -79.74 -34.13 40.23 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.222 0.534 . . . . 0.0 110.426 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -117.53 94.58 45.92 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.718 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -60.87 -2.83 2.36 Favored 'Trans proline' 0 N--CA 1.474 0.381 0 C-N-CA 123.201 2.6 . . . . 0.0 113.921 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -96.98 -18.92 19.13 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.955 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.602 HG23 HD22 ' A' ' 34' ' ' LEU . 23.5 mt -77.25 108.59 10.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.33 145.2 28.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.515 -173.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.489 HD13 ' HB2' ' A' ' 88' ' ' PHE . 7.8 tp -103.85 129.2 51.29 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.573 HD12 HD23 ' A' ' 79' ' ' LEU . 1.3 mp -112.7 121.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.091 0.472 . . . . 0.0 109.876 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.799 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -98.38 138.87 34.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.844 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.97 95.33 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.489 0.662 . . . . 0.0 109.462 174.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 1.073 ' HA ' HH21 ' A' ' 94' ' ' ARG . 1.8 tpt85 -152.24 163.85 38.57 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.274 -0.876 . . . . 0.0 108.774 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.49 139.92 31.81 Favored Pre-proline 0 C--N 1.322 -0.61 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.15 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -62.09 -19.32 65.97 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.322 2.681 . . . . 0.0 115.059 -166.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.45 ' HB2' ' OE2' ' B' ' 50' ' ' GLU . 0.1 OUTLIER -76.7 -39.2 52.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.041 -0.664 . . . . 0.0 111.386 -178.927 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.19 -37.55 66.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.455 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.8 OUTLIER -59.34 -45.84 90.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.234 0.54 . . . . 0.0 110.912 177.327 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -35.52 80.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.85 -177.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.87 -48.52 12.26 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -175.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -92.62 -36.79 12.79 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.578 -0.449 . . . . 0.0 112.199 -173.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.3 173.19 13.51 Favored Glycine 0 N--CA 1.44 -1.097 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.819 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.553 ' HB2' ' HD2' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -149.04 165.7 17.09 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.729 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.553 ' HD2' ' HB2' ' A' ' 56' ' ' LYS . 18.6 Cg_endo -63.78 123.63 12.3 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 121.881 1.72 . . . . 0.0 112.387 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -94.16 71.97 3.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.072 0.463 . . . . 0.0 110.044 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.452 HG21 ' HB3' ' A' ' 62' ' ' TYR . 4.5 m -115.94 174.41 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.34 -24.27 32.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.812 0.339 . . . . 0.0 111.383 -176.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -125.43 66.45 1.15 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.384 0.612 . . . . 0.0 111.335 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.799 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 0.8 OUTLIER -132.84 139.13 47.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.623 177.332 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.449 ' HE3' HD22 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -135.36 135.72 40.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.975 0.417 . . . . 0.0 110.533 176.399 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.0 t-160 -93.18 115.63 28.25 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.493 178.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.4 171.24 7.88 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 178.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.27 170.57 14.73 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 175.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.492 ' HB2' ' S4 ' ' B' ' 139' ' ' PS5 . 0.3 OUTLIER -94.23 -44.9 7.75 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.021 -175.858 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.481 ' HA3' ' HB3' ' B' ' 92' ' ' ALA . . . -102.43 -45.33 1.7 Allowed Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.81 -0.71 . . . . 0.0 111.499 175.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' O ' ' HD2' ' A' ' 72' ' ' PRO . 3.6 mttm -89.11 35.4 0.8 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.301 -0.45 . . . . 0.0 110.619 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.514 HD13 HD12 ' A' ' 74' ' ' LEU . 0.2 OUTLIER -68.02 -35.09 77.72 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.56 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.952 ' HB3' ' HB3' ' B' ' 11' ' ' PHE . 0.0 OUTLIER -45.01 -57.62 6.85 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.757 -174.603 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.492 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 74.0 Cg_endo -73.65 -15.87 24.14 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.051 1.834 . . . . 0.0 112.605 178.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.526 HD21 ' HA ' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -81.29 -22.32 38.68 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.283 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.542 HD22 HD22 ' A' ' 102' ' ' LEU . 3.7 tp -58.31 -53.16 61.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.137 177.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.01 -27.38 68.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.585 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.91 -22.54 39.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.755 0.312 . . . . 0.0 111.235 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' SER . . . . . 0.431 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 49.8 m -79.57 -35.82 39.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.9 -177.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.18 63.39 1.04 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.521 -0.847 . . . . 0.0 111.869 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . 0.573 HD23 HD12 ' A' ' 43' ' ' ILE . 43.7 mt -110.45 136.67 49.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.574 0.226 . . . . 0.0 110.408 -179.092 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASP . . . . . 0.489 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -121.52 138.81 28.81 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.238 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . 0.486 ' HD2' ' O ' ' B' ' 1' ' ' ALA . 31.9 Cg_endo -68.56 8.01 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.903 2.402 . . . . 0.0 113.719 -174.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -102.27 -17.44 15.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 122.106 -0.371 . . . . 0.0 110.616 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.489 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -93.69 126.19 50.64 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.684 178.499 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.616 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 18.1 Cg_exo -65.36 143.75 77.68 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.769 2.313 . . . . 0.0 111.362 177.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.802 HG22 HD13 ' A' ' 110' ' ' ILE . 2.4 m -137.72 149.65 25.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.076 0.465 . . . . 0.0 111.046 -178.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.558 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 0.7 OUTLIER -125.74 142.91 41.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.488 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.502 ' N ' HG21 ' A' ' 86' ' ' VAL . 2.9 m -103.4 134.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.951 0.405 . . . . 0.0 110.608 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' PHE . . . . . 0.609 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.0 OUTLIER -120.12 141.47 49.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.939 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 46.8 t -173.39 -76.81 0.01 OUTLIER 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.887 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.824 ' HA ' ' HA3' ' A' ' 116' ' ' GLY . 0.0 OUTLIER -172.1 -175.44 1.45 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.443 177.332 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.94 65.53 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 123.393 0.433 . . . . 0.0 111.209 179.239 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.544 ' CB ' ' HA3' ' B' ' 68' ' ' GLY . . . -153.03 176.5 11.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.162 0.506 . . . . 0.0 112.228 -173.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.619 ' HB3' HG11 ' A' ' 15' ' ' VAL . . . -74.28 -25.0 59.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.069 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ARG . . . . . 1.073 HH21 ' HA ' ' A' ' 46' ' ' ARG . 1.7 ttt180 -43.77 -51.0 7.56 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -173.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.74 -31.3 70.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.971 0.415 . . . . 0.0 111.299 -178.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -28.56 69.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.287 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.74 -38.89 92.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.695 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.9 -46.76 33.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.693 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.547 ' HA2' HD12 ' A' ' 110' ' ' ILE . . . -65.46 -55.48 20.47 Favored Glycine 0 CA--C 1.519 0.299 0 C-N-CA 121.058 -0.591 . . . . 0.0 113.57 -176.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.532 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -61.86 -32.86 73.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.813 0.34 . . . . 0.0 111.199 -174.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.477 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 44.1 m -72.88 -38.74 66.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.782 0.325 . . . . 0.0 110.974 177.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.542 HD22 HD22 ' A' ' 74' ' ' LEU . 11.6 mt -64.3 -45.2 89.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.47 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ARG . . . . . 0.532 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.1 -27.47 68.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.919 0.39 . . . . 0.0 110.597 179.157 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.19 -6.73 41.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.368 178.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' TYR . . . . . 0.45 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 22.6 m-85 -104.21 -5.42 21.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.784 0.326 . . . . 0.0 110.543 176.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 107.07 34.61 2.93 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.952 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -78.23 139.27 38.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.682 0.277 . . . . 0.0 110.44 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -60.85 3.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.751 -172.248 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.616 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -139.23 120.01 14.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.294 -178.573 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.802 HD13 HG22 ' A' ' 85' ' ' VAL . 0.7 OUTLIER -121.37 127.16 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.23 0.538 . . . . 0.0 111.397 -176.712 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.558 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 1.9 m-85 -118.52 145.76 45.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.261 -176.118 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . 0.713 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 38.4 t-20 -117.12 143.41 45.84 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.583 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -97.23 115.46 27.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -172.851 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLU . . . . . 0.842 ' HG2' ' HE2' ' A' ' 24' ' ' MET . 2.9 mm-40 -76.32 33.96 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 113' ' ' SER . . . -139.84 -78.44 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.315 -179.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . 0.824 ' HA3' ' HA ' ' A' ' 90' ' ' LYS . . . 114.02 178.8 19.14 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.548 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' MET . . . . . 0.405 ' SD ' ' HD3' ' A' ' 57' ' ' PRO . 10.4 tpp -53.61 -38.49 64.07 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.017 0.437 . . . . 0.0 111.178 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -58.48 -41.66 85.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.573 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' LYS . . . . . 0.467 ' O ' ' HB2' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.8 -32.66 63.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.355 179.598 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.609 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -61.11 -53.66 54.26 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 9.1 mt -63.68 -42.19 98.06 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.109 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.41 -41.49 93.53 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.804 -177.462 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . 0.559 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -67.08 -21.2 65.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.913 0.387 . . . . 0.0 110.972 -177.343 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 90.5 21.87 36.14 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.883 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . 0.559 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 24.3 mt -75.97 159.53 80.54 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 177.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.489 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 14.4 Cg_endo -54.17 114.03 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.973 2.449 . . . . 0.0 111.704 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.05 148.78 41.93 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 120.991 0.424 . . . . 0.0 110.698 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.5 mt -97.02 100.77 12.26 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.96 158.82 43.86 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -175.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.87 68.8 4.0 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.024 0.44 . . . . 0.0 111.039 -176.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.97 158.12 37.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.925 177.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -78.6 60.48 2.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.967 0.413 . . . . 0.0 111.814 -175.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -128.64 148.28 50.79 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 172.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -76.5 92.58 3.44 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.413 0.625 . . . . 0.0 110.909 -175.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -139.61 136.41 34.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.287 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -136.99 164.74 27.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 118.211 -0.9 . . . . 0.0 109.924 178.779 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . 0.486 ' O ' ' HD2' ' A' ' 81' ' ' PRO . . . . . . . . 0 N--CA 1.474 0.769 0 CA-C-O 120.91 0.386 . . . . 0.0 110.119 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.95 80.78 4.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.24 0.543 . . . . 0.0 110.138 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' MET . . . . . 0.412 ' HG2' ' HG3' ' B' ' 6' ' ' LYS . 14.1 mtp -101.75 33.04 3.14 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.374 -173.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' GLY . . . . . 0.587 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.49 -35.03 78.04 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.319 -0.467 . . . . 0.0 113.434 -177.625 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.83 -31.88 66.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.012 0.434 . . . . 0.0 110.561 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LYS . . . . . 0.425 ' HD3' ' HA ' ' B' ' 6' ' ' LYS . 6.2 mmtt -71.31 -57.8 4.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.134 -173.229 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . 0.587 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.6 p90 -73.01 -35.59 66.84 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.103 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.33 -56.08 22.1 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.83 0.348 . . . . 0.0 110.877 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.08 -46.55 85.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.801 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.53 -41.87 92.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.536 -177.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' PHE . . . . . 0.952 ' HB3' ' HB3' ' A' ' 71' ' ' GLU . 0.3 OUTLIER -54.11 -43.89 70.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.217 0.532 . . . . 0.0 110.525 -178.045 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -65.24 -24.43 67.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.619 177.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.41 -49.78 21.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.38 . . . . 0.0 110.853 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 65.2 mt-30 -71.33 -52.0 21.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.896 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.29 -33.47 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.146 -177.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -70.94 -34.92 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.2 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -26.74 68.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.934 0.397 . . . . 0.0 111.065 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.17 72.03 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.631 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' LYS . . . . . 0.517 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 6.9 mtmt -76.07 -22.38 55.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.351 0.596 . . . . 0.0 111.008 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.28 -19.02 61.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.122 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.62 -5.46 56.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.527 -177.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' MET . . . . . 0.523 ' HE1' ' HB2' ' B' ' 22' ' ' MET . 1.5 mpp? -122.16 176.33 5.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.567 0.222 . . . . 0.0 110.79 -179.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 31.5 t -88.37 105.03 15.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' MET . . . . . 0.517 ' SD ' ' HB3' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -75.68 111.28 10.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.998 0.428 . . . . 0.0 110.767 -175.223 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' LEU . . . . . 0.427 ' HA ' HD21 ' B' ' 25' ' ' LEU . 5.2 mt -124.17 144.29 50.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.081 -176.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.15 146.04 61.97 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.547 176.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -51.52 -21.56 10.84 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.522 2.815 . . . . 0.0 114.104 -175.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -75.03 -47.45 28.95 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.053 0.454 . . . . 0.0 110.821 175.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.02 -32.63 72.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.82 -47.79 61.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.967 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' TYR . . . . . 0.486 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 86.2 t80 -67.02 -29.73 69.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.748 178.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.96 -53.51 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.82 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -74.08 -27.59 60.97 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.01 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . 0.49 HD22 ' O ' ' B' ' 40' ' ' ILE . 0.2 OUTLIER -62.53 -45.84 91.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.136 178.454 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -75.87 -26.99 57.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.487 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 -29.43 26.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.813 0.339 . . . . 0.0 110.771 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -125.68 98.73 33.77 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.268 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.64 2.74 1.8 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.13 2.554 . . . . 0.0 112.871 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -90.33 -20.77 22.51 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ILE . . . . . 0.583 HG12 ' HB2' ' B' ' 84' ' ' PRO . 41.1 mt -80.22 112.52 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.123 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' THR . . . . . 0.424 ' HB ' HG11 ' B' ' 85' ' ' VAL . 1.9 m -94.72 140.64 29.62 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.057 -178.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.615 HD12 ' HB2' ' B' ' 88' ' ' PHE . 8.0 tp -105.12 123.82 48.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' ILE . . . . . 0.597 HD12 HD12 ' B' ' 79' ' ' LEU . 2.1 mp -110.29 115.53 49.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.573 177.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ASP . . . . . 0.786 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.3 OUTLIER -99.06 140.51 33.11 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.553 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.87 94.7 2.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.655 0.741 . . . . 0.0 109.84 174.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . 0.69 ' HG2' HH21 ' B' ' 94' ' ' ARG . 21.0 mtp85 -145.44 164.18 32.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.362 178.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.479 ' OD1' ' HD3' ' B' ' 67' ' ' ARG . 5.7 m-20 -73.28 134.25 80.27 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.242 -173.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -65.05 -21.39 63.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.449 2.766 . . . . 0.0 114.621 -169.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.35 -31.31 48.5 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.251 -0.579 . . . . 0.0 110.268 177.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' GLU . . . . . 0.45 ' OE2' ' HB2' ' A' ' 49' ' ' ASP . 2.3 mm-40 -70.91 -40.88 71.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.046 173.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.453 HD13 ' HE2' ' B' ' 117' ' ' MET . 0.5 OUTLIER -60.2 -33.57 72.42 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.605 176.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -39.12 54.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.512 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.47 -46.83 13.98 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 4.1 mtm -97.65 -35.06 10.71 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.716 -0.393 . . . . 0.0 111.5 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.42 173.17 14.2 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.262 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' LYS . . . . . 0.429 ' HG2' ' HB2' ' B' ' 128' ' ' LEU . 0.0 OUTLIER -138.82 156.73 72.65 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.401 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' PRO . . . . . 0.48 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 16.4 Cg_endo -60.8 125.21 16.64 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.647 2.231 . . . . 0.0 112.956 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . 0.792 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 17.7 t0 -97.5 96.3 8.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.236 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' VAL . . . . . 0.563 ' CG2' ' HB2' ' B' ' 62' ' ' TYR . 34.9 m -130.89 164.65 33.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.302 176.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -38.95 77.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.564 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -124.6 75.89 1.45 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.14 0.495 . . . . 0.0 110.851 -177.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' TYR . . . . . 0.786 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 13.5 t80 -118.08 126.02 51.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.451 -178.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.591 ' HE3' HD22 ' B' ' 79' ' ' LEU . 15.4 mttm -128.04 120.48 27.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.964 0.412 . . . . 0.0 110.346 178.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' HIS . . . . . 0.484 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 11.5 t-160 -95.83 114.2 25.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' MET . . . . . 0.441 ' SD ' ' HA ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER -96.22 170.73 9.05 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 177.887 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' SER . . . . . 0.479 ' HB3' ' S5 ' ' A' ' 138' ' ' PS5 . 0.3 OUTLIER -70.87 141.87 51.22 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 172.134 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' ARG . . . . . 0.479 ' HD3' ' OD1' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -63.43 -40.71 97.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.022 0.439 . . . . 0.0 111.697 -172.13 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' GLY . . . . . 0.544 ' HA3' ' CB ' ' A' ' 92' ' ' ALA . . . -103.34 -45.66 1.54 Allowed Glycine 0 N--CA 1.44 -1.05 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.435 176.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.47 39.27 0.72 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.333 -0.433 . . . . 0.0 110.776 -179.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' LEU . . . . . 0.56 HD12 ' HB3' ' B' ' 98' ' ' ALA . 0.1 OUTLIER -73.74 -31.92 63.6 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 175.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' GLU . . . . . 0.516 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.3 -60.32 4.21 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.295 -175.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' PRO . . . . . 0.544 ' HG3' ' HD3' ' A' ' 12' ' ' LYS . 3.5 Cg_exo -74.66 -16.36 21.16 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.692 2.261 . . . . 0.0 112.916 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -91.11 -21.74 21.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.678 0.275 . . . . 0.0 111.458 -174.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' LEU . . . . . 0.441 ' HA ' ' SD ' ' B' ' 65' ' ' MET . 3.4 tp -61.02 -51.27 69.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.607 -173.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' ALA . . . . . 0.451 ' CB ' ' HB2' ' A' ' 8' ' ' ASP . . . -74.1 -17.49 60.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -76.15 -24.7 54.84 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -176.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.64 -28.0 51.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.8 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.67 83.41 1.56 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.303 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . 0.597 HD12 HD12 ' B' ' 43' ' ' ILE . 12.0 mt -126.0 144.68 50.61 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.199 -0.296 . . . . 0.0 110.199 179.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' ASP . . . . . 0.456 ' OD1' ' HA ' ' A' ' 1' ' ' ALA . 16.2 t70 -114.11 130.51 23.85 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' PRO . . . . . 0.641 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 33.8 Cg_endo -68.47 -6.81 18.55 Favored 'Trans proline' 0 N--CA 1.472 0.255 0 C-N-CA 122.921 2.414 . . . . 0.0 113.912 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -98.95 2.58 46.57 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.42 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -106.76 142.66 25.44 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.132 177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' PRO . . . . . 0.583 ' HB2' HG12 ' B' ' 40' ' ' ILE . 16.9 Cg_exo -69.35 134.71 29.53 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.545 2.163 . . . . 0.0 111.859 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' VAL . . . . . 0.478 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 5.6 m -135.65 147.91 28.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.39 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' VAL . . . . . 0.457 ' HB ' ' CD1' ' B' ' 111' ' ' TYR . 0.5 OUTLIER -126.5 141.42 46.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.784 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' VAL . . . . . 0.447 ' N ' HG21 ' B' ' 86' ' ' VAL . 3.3 m -103.28 122.1 55.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.057 0.456 . . . . 0.0 110.062 179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' PHE . . . . . 0.646 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 7.3 t80 -110.28 143.87 39.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.702 -175.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 53.4 t 178.78 -67.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.92 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.689 ' HA ' ' HA2' ' B' ' 116' ' ' GLY . 0.0 OUTLIER -176.9 -173.79 0.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.197 179.533 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -80.16 61.86 4.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.838 0.352 . . . . 0.0 110.269 175.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' ALA . . . . . 0.481 ' HB3' ' HA3' ' A' ' 68' ' ' GLY . . . -137.89 167.17 22.31 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.23 0.538 . . . . 0.0 112.136 -172.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -69.48 -26.02 64.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.079 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' ARG . . . . . 0.69 HH21 ' HG2' ' B' ' 46' ' ' ARG . 0.8 OUTLIER -47.85 -49.8 28.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.693 -178.213 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.14 -36.2 66.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.932 0.396 . . . . 0.0 110.812 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.97 -28.99 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.513 -179.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -40.4 90.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.965 0.412 . . . . 0.0 110.502 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' ALA . . . . . 0.56 ' HB3' HD12 ' B' ' 70' ' ' LEU . . . -70.37 -40.42 74.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.72 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 99' ' ' GLY . . . . . 0.555 ' HA2' HD12 ' B' ' 110' ' ' ILE . . . -76.92 -49.87 7.36 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.799 -0.715 . . . . 0.0 113.615 -176.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 100' ' ' LYS . . . . . 0.581 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -64.79 -30.14 71.14 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.558 -0.378 . . . . 0.0 111.873 -172.238 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 3.2 m -72.03 -35.9 69.52 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.12 0.486 . . . . 0.0 110.163 175.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 102' ' ' LEU . . . . . 0.424 HD23 HD22 ' B' ' 74' ' ' LEU . 9.2 mt -67.1 -42.69 84.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.736 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 103' ' ' ARG . . . . . 0.581 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -62.25 -27.28 68.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.986 0.422 . . . . 0.0 110.497 179.799 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -6.75 42.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.736 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -104.38 -7.99 19.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.836 0.351 . . . . 0.0 110.634 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 111.52 15.28 10.49 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.655 175.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' PHE . . . . . 0.641 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 6.7 m-85 -61.88 125.79 25.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.793 0.33 . . . . 0.0 110.495 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -76.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.077 -172.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' THR . . . . . 0.56 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -117.33 104.4 11.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.523 -174.172 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' ILE . . . . . 0.555 HD12 ' HA2' ' B' ' 99' ' ' GLY . 1.5 tt -114.97 125.75 72.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.164 0.507 . . . . 0.0 110.967 -176.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' TYR . . . . . 0.457 ' CD1' ' HB ' ' B' ' 86' ' ' VAL . 1.1 m-85 -115.3 143.79 44.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.776 -175.059 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -114.28 143.34 45.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 88.7 p -79.74 129.09 34.18 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.839 0.352 . . . . 0.0 111.53 -172.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -97.61 8.18 45.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.082 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -122.3 -96.16 1.33 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.741 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 116' ' ' GLY . . . . . 0.689 ' HA2' ' HA ' ' B' ' 90' ' ' LYS . . . 156.64 172.81 24.37 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.007 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 117' ' ' MET . . . . . 0.647 ' SD ' ' HD3' ' B' ' 46' ' ' ARG . 36.1 ttm -62.25 -35.38 78.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.08 0.467 . . . . 0.0 110.22 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -33.56 74.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.194 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.01 -33.81 66.0 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.035 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 120' ' ' TRP . . . . . 0.646 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.6 t-105 -58.68 -51.9 67.97 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 18.7 mt -62.93 -40.01 96.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.992 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.71 -43.33 80.3 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.335 -175.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.4 0.87 10.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.663 0.268 . . . . 0.0 111.244 -176.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 76.74 24.43 67.29 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.043 -0.598 . . . . 0.0 112.337 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 125' ' ' LEU . . . . . 0.528 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 77.6 mt -77.39 161.29 73.06 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 126' ' ' PRO . . . . . 0.528 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 38.2 Cg_endo -66.86 129.86 21.82 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.781 2.321 . . . . 0.0 112.29 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.74 148.73 52.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.814 0.34 . . . . 0.0 110.773 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 128' ' ' LEU . . . . . 0.792 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.7 mt -95.69 105.98 18.04 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 175.478 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.14 158.38 44.56 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.806 -178.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -81.18 70.73 8.09 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.026 0.441 . . . . 0.0 110.109 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 131' ' ' SER . . . . . 0.402 ' C ' ' H ' ' B' ' 133' ' ' HIS . 0.5 OUTLIER -65.59 156.27 33.25 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.281 -176.127 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.65 25.17 0.26 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.62 -178.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 133' ' ' HIS . . . . . 0.402 ' H ' ' C ' ' B' ' 131' ' ' SER . 14.9 t-80 -77.75 -17.42 57.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.722 -0.217 . . . . 0.0 110.829 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.75 70.61 0.44 Allowed 'General case' 0 C--O 1.234 0.242 0 O-C-N 123.731 0.645 . . . . 0.0 110.475 -178.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -118.48 108.48 15.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.651 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -69.1 134.22 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.193 0.521 . . . . 0.0 111.007 -176.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.207 -0.901 . . . . 0.0 109.824 -179.167 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' PS5 . . . . . 0.479 ' S5 ' ' HB3' ' B' ' 66' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 139' ' ' PS5 . . . . . 0.492 ' S4 ' ' HB2' ' A' ' 67' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.559 ' SD ' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.178 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.653 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -58.95 -38.32 92.55 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.961 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -71.42 -38.67 71.39 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.985 0.421 . . . . 0.0 110.488 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.559 ' HG3' ' SD ' ' A' ' 3' ' ' MET . 7.7 mmtt -60.54 -56.37 22.2 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.534 -176.218 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.653 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 1.1 p90 -76.46 -21.96 55.19 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 119.89 -0.724 . . . . 0.0 111.793 -175.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.713 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 0.0 OUTLIER -52.45 -46.11 66.34 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 123.447 0.467 . . . . 0.0 111.013 -178.103 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.43 -42.03 81.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.342 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.489 ' HB ' ' CE1' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -67.61 -43.13 81.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.287 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.503 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.6 OUTLIER -57.69 -44.45 85.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.301 179.282 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.661 ' HD2' ' HG3' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -66.46 -26.52 67.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.373 178.117 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.86 -42.37 63.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.078 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.0 -51.03 23.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.173 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.77 -38.37 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.237 -173.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.661 ' HG3' ' HD2' ' A' ' 12' ' ' LYS . 0.9 OUTLIER -69.55 -32.62 71.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 0.0 111.368 -177.808 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.24 -26.12 66.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.384 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.38 -36.11 80.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.136 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.03 -22.28 49.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.288 0.566 . . . . 0.0 110.962 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.43 -19.13 50.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.544 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.78 -33.81 75.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.12 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.684 ' HB3' ' HD3' ' A' ' 103' ' ' ARG . 8.6 ptm -116.99 -172.61 2.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.211 0.529 . . . . 0.0 112.274 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.6 t -79.84 112.96 18.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.272 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 120.97 29.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.019 0.437 . . . . 0.0 110.491 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 25' ' ' LEU . 2.3 mt -118.2 -168.47 1.53 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.902 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -126.61 144.13 48.7 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 173.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.423 ' HB2' ' CD1' ' A' ' 125' ' ' LEU . 1.2 Cg_endo -46.77 -30.37 9.19 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 123.933 3.089 . . . . 0.0 114.209 -174.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm -75.02 -43.8 51.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.943 0.401 . . . . 0.0 110.792 176.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.2 -32.24 73.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.393 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.639 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.01 -47.97 40.42 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.78 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.708 ' HA ' HD12 ' A' ' 34' ' ' LEU . 83.9 t80 -62.97 -33.41 75.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.862 178.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -53.9 -52.57 60.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.187 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.502 HD13 HG21 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -74.05 -26.18 60.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.364 179.756 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.708 HD12 ' HA ' ' A' ' 31' ' ' TYR . 99.0 mt -65.64 -48.77 71.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 111.275 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.69 -28.55 58.69 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.707 -174.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -86.59 -37.02 18.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.11 0.481 . . . . 0.0 110.511 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -116.48 97.43 50.0 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.77 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.566 ' HA ' ' ND2' ' A' ' 61' ' ' ASN . 35.7 Cg_endo -67.02 3.73 1.45 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 122.912 2.408 . . . . 0.0 112.902 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -91.38 -27.94 18.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.015 0.436 . . . . 0.0 110.24 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.508 HG12 ' HG2' ' A' ' 84' ' ' PRO . 25.0 mt -81.88 109.74 16.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.817 175.096 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.675 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -99.08 145.65 26.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.697 -175.16 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.651 HD11 ' HB2' ' A' ' 88' ' ' PHE . 2.7 tp -101.44 133.26 46.34 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.6 mt -112.77 117.1 54.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.529 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.856 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.1 OUTLIER -99.21 138.38 36.4 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.666 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.17 98.73 5.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.534 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.797 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -156.76 162.89 39.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.445 178.551 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.797 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 3.4 m-20 -80.68 157.97 71.45 Favored Pre-proline 0 C--N 1.318 -0.777 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.162 -174.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 36.6 Cg_endo -72.1 -23.1 21.83 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.859 2.373 . . . . 0.0 114.758 -170.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.454 ' HB2' ' HG3' ' B' ' 50' ' ' GLU . 3.7 t70 -78.14 -37.86 45.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.704 -0.798 . . . . 0.0 111.763 -177.002 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 46' ' ' ARG . 1.4 tt0 -70.53 -39.28 74.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.749 175.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.845 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 mp -59.56 -34.8 73.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.293 177.059 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -78.94 -45.13 21.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.164 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.54 -47.97 13.43 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 6.4 mmm -98.63 -36.25 9.94 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.629 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 173.3 14.15 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.536 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.845 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -143.64 162.28 42.42 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.199 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.46 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.5 Cg_endo -59.53 133.34 51.2 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.391 2.061 . . . . 0.0 113.156 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -95.9 95.36 8.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.063 174.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 1.048 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -129.88 145.08 36.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.289 -178.377 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.84 95.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.308 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.675 ' HB2' HG23 ' A' ' 41' ' ' THR . 0.8 OUTLIER -110.89 76.8 1.0 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.255 -178.566 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 1.048 ' HB2' HG23 ' A' ' 59' ' ' VAL . 4.9 t80 -120.34 125.92 49.22 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.162 -171.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.461 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 2.6 mtmt -122.88 113.12 18.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 174.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 62' ' ' TYR . 11.5 t-160 -92.39 113.08 25.25 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.993 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.665 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.744 -174.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.634 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.2 OUTLIER -45.88 -63.94 1.1 Allowed Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.622 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.634 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 7.7 Cg_exo -74.49 -16.11 21.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.4 2.066 . . . . 0.0 113.159 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.801 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.8 OUTLIER -90.71 -15.66 29.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.33 -175.255 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.681 HD13 HD11 ' A' ' 70' ' ' LEU . 42.8 tp -57.13 -53.28 59.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.3 0.571 . . . . 0.0 110.729 -178.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.439 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -69.39 -22.6 63.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.357 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 4.3 mttm -73.8 -30.12 62.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.765 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.461 ' HB2' ' HD2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -78.18 -37.36 45.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.94 0.4 . . . . 0.0 110.449 -178.929 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.98 86.8 1.97 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.627 -176.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.48 145.12 51.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.872 0.368 . . . . 0.0 111.097 -177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.41 ' OD1' ' HD2' ' A' ' 81' ' ' PRO . 3.1 t0 -129.15 146.58 61.39 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 40.9 Cg_endo -69.77 9.19 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.987 2.458 . . . . 0.0 113.872 -175.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.49 18.61 15.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.322 0.582 . . . . 0.0 110.004 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -111.63 127.37 26.98 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.442 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.508 ' HG2' HG12 ' A' ' 40' ' ' ILE . 5.9 Cg_exo -75.57 129.35 11.76 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.426 2.084 . . . . 0.0 111.172 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.502 HG23 HD12 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -139.11 151.04 23.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.053 -177.183 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.8 p -127.32 144.83 36.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.558 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 8.2 m -112.15 142.24 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.734 0.302 . . . . 0.0 110.725 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.769 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.0 OUTLIER -108.69 158.2 17.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.495 -178.667 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' CYS . . . . . 0.422 ' SG ' ' HG2' ' A' ' 46' ' ' ARG . 1.0 OUTLIER . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.417 0.627 . . . . 0.0 111.481 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.558 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 109.908 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -33.49 70.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.712 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -74.23 -30.39 62.15 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.34 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.84 -40.73 54.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.745 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.47 -46.12 3.31 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.518 -0.849 . . . . 0.0 113.598 -172.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.41 -24.24 67.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.705 0.288 . . . . 0.0 111.227 -174.29 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.43 -49.65 66.01 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.442 175.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 74' ' ' LEU . 39.4 mt -58.48 -41.95 86.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.446 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.684 ' HD3' ' HB3' ' A' ' 22' ' ' MET . 0.0 OUTLIER -71.53 -27.12 62.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 0.0 110.578 177.356 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.38 -9.35 58.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.705 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.483 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 19.4 m-85 -100.24 -40.86 7.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 144.56 41.13 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.259 175.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.438 ' CE1' HD22 ' A' ' 102' ' ' LEU . 4.0 m-85 -88.05 138.76 31.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.931 0.366 . . . . 0.0 110.367 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -61.32 -72.83 0.11 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.874 -174.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.86 107.44 10.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.064 0.459 . . . . 0.0 111.247 -176.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.502 HD12 HG23 ' A' ' 85' ' ' VAL . 1.2 tt -117.61 132.73 66.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.566 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -115.0 146.09 41.59 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.578 -177.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.407 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 5.7 t-20 -113.21 141.33 47.09 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 172.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -96.31 111.71 23.69 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.732 0.301 . . . . 0.0 111.806 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 115' ' ' GLY . 1.8 tp10 -62.05 149.7 40.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.099 177.283 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.621 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 89.86 -108.4 3.51 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.583 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.53 -161.46 32.68 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' MET . . . . . 0.434 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 35.9 tpp -60.5 -32.65 71.65 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.042 0.448 . . . . 0.0 110.725 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -61.79 -33.91 74.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.268 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.621 ' HD3' ' HA3' ' A' ' 115' ' ' GLY . 0.0 OUTLIER -73.85 -33.13 63.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 111.42 0.155 . . . . 0.0 111.42 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.769 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -62.77 -54.04 45.11 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 15.6 mt -62.12 -43.81 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.378 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -74.79 -33.42 62.25 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -172.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -76.94 3.24 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 122.269 -0.269 . . . . 0.0 111.669 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.11 18.55 74.33 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.359 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 120' ' ' TRP . 86.8 mt -76.52 154.24 83.75 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-O 120.834 0.349 . . . . 0.0 110.552 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.481 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 26.4 Cg_endo -57.98 111.25 0.79 Allowed 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 123.066 2.511 . . . . 0.0 111.951 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.84 146.97 47.08 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.88 101.55 13.24 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.872 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.915 -175.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 3' ' ' MET . . . . . 0.604 ' SD ' ' HG3' ' B' ' 6' ' ' LYS . 4.8 tpp . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.948 0.404 . . . . 0.0 110.066 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 4' ' ' GLY . . . . . 0.756 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.05 -49.19 81.11 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.599 -0.728 . . . . 0.0 113.276 -177.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -31.91 68.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.064 0.459 . . . . 0.0 111.117 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.604 ' HG3' ' SD ' ' B' ' 3' ' ' MET . 15.0 mmtp -75.57 -57.99 3.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.406 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.756 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -79.23 -23.6 43.63 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.858 -0.737 . . . . 0.0 112.485 -174.489 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ASP . . . . . 0.439 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 17.8 t0 -53.82 -42.45 68.44 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.996 0.427 . . . . 0.0 110.536 -178.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.44 -35.34 68.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.307 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.06 -47.53 68.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.458 0.171 . . . . 0.0 111.417 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' PHE . . . . . 0.568 ' CD2' HD22 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -57.23 -38.47 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.29 0.567 . . . . 0.0 110.317 179.563 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 12' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.1 OUTLIER -68.08 -27.06 66.16 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.371 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.91 -44.29 49.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -69.74 -50.59 41.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.29 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.582 HG11 ' HG2' ' A' ' 71' ' ' GLU . 0.9 OUTLIER -61.57 -33.27 56.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.304 -178.628 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.575 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -71.69 -33.73 69.06 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.423 179.485 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.54 64.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.122 0.486 . . . . 0.0 110.888 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.73 -32.84 70.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.061 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.39 -24.2 42.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.06 0.457 . . . . 0.0 111.024 173.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.38 -26.19 46.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.057 -176.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.574 ' O ' ' HD3' ' B' ' 103' ' ' ARG . 3.8 t0 -85.86 21.03 2.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.659 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 9.7 mtp -143.38 156.03 44.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.468 -178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 61.2 t -81.76 100.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' MET . . . . . 0.408 ' SD ' ' HG2' ' B' ' 114' ' ' GLU . 0.0 OUTLIER -74.67 112.85 11.28 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.168 0.509 . . . . 0.0 111.111 -174.75 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 25' ' ' LEU . . . . . 0.47 ' HA ' HD23 ' B' ' 25' ' ' LEU . 2.5 mt -123.76 144.81 49.46 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.198 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 141.71 49.18 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.203 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.441 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 1.6 Cg_endo -46.77 -24.17 2.86 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.404 3.403 . . . . 0.0 115.083 -174.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -74.43 -43.78 54.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.0 0.428 . . . . 0.0 110.626 177.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -72.65 -32.56 65.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.009 175.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.656 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -66.09 -52.2 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.778 178.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 31' ' ' TYR . . . . . 0.798 ' HA ' HD12 ' B' ' 34' ' ' LEU . 59.8 t80 -63.66 -29.87 71.05 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 122.221 -0.299 . . . . 0.0 111.063 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -52.75 63.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.056 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.651 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.2 OUTLIER -68.95 -26.51 65.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.259 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' B' ' 31' ' ' TYR . 46.8 mt -70.62 -49.69 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.023 0.439 . . . . 0.0 111.261 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -76.28 -24.65 54.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.233 -173.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.65 -34.19 15.53 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.129 -178.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.53 ' HB2' HG13 ' B' ' 40' ' ' ILE . 0.5 OUTLIER -126.64 102.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.563 -177.46 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -70.23 8.29 0.91 Allowed 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 123.327 2.685 . . . . 0.0 113.947 -176.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -92.33 -27.41 17.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.283 0.563 . . . . 0.0 109.588 173.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.913 HG12 ' HG2' ' B' ' 84' ' ' PRO . 2.8 mt -82.53 99.41 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.841 175.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.631 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -90.28 145.17 25.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.362 -176.096 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.928 HD11 ' HB2' ' B' ' 88' ' ' PHE . 2.5 tp -102.89 130.3 49.89 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.564 HG12 ' HE2' ' B' ' 65' ' ' MET . 94.4 mt -109.01 118.7 57.12 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.807 178.083 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.825 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -97.13 122.48 40.18 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.633 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.56 98.41 6.43 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 115.045 -0.98 . . . . 0.0 108.632 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' ARG . . . . . 0.634 ' HG3' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -161.41 169.89 21.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.993 -174.123 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.96 142.44 76.31 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 177.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -78.81 -19.23 11.22 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.683 2.255 . . . . 0.0 114.028 -174.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.41 -48.88 25.04 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 122.097 -0.377 . . . . 0.0 111.391 -176.002 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 50' ' ' GLU . . . . . 0.454 ' HG3' ' HB2' ' A' ' 49' ' ' ASP . 0.9 OUTLIER -67.74 -29.33 68.53 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 174.561 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -44.5 97.11 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.051 174.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -59.39 -38.68 81.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.98 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.61 -47.98 10.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.823 -171.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.71 -34.68 11.85 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -170.31 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.87 163.64 11.31 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.655 178.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.04 152.58 70.32 Favored Pre-proline 0 C--N 1.327 -0.4 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -58.39 122.79 12.27 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.521 2.147 . . . . 0.0 112.893 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -98.61 79.72 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.339 0.59 . . . . 0.0 110.272 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.631 HG22 ' HB2' ' B' ' 62' ' ' TYR . 1.2 m -113.43 162.78 11.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 178.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -41.33 88.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.315 -174.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.434 ' HB2' HG23 ' B' ' 41' ' ' THR . 19.9 p30 -121.26 67.84 0.88 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.522 0.677 . . . . 0.0 111.208 -177.535 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' TYR . . . . . 0.825 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -105.52 125.32 50.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.808 176.736 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.631 ' HE2' HG21 ' B' ' 41' ' ' THR . 3.7 mtmt -123.01 120.88 34.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.004 0.431 . . . . 0.0 110.617 176.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 64' ' ' HIS . . . . . 0.464 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 12.9 t-160 -87.22 113.69 23.18 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 65' ' ' MET . . . . . 0.923 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.636 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.17 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.795 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.653 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -44.79 -59.49 4.05 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -174.836 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.653 ' HD3' ' CD ' ' B' ' 71' ' ' GLU . 11.9 Cg_exo -73.93 -17.38 22.52 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.453 2.102 . . . . 0.0 113.392 -176.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.923 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -91.11 -21.88 20.98 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.73 0.3 . . . . 0.0 110.636 -177.502 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.672 HD21 HD21 ' B' ' 102' ' ' LEU . 10.6 tp -62.34 -29.02 70.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.452 0.644 . . . . 0.0 110.885 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.713 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -77.22 -30.24 54.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.782 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.45 -7.18 32.19 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -171.675 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -27.02 57.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.807 0.337 . . . . 0.0 111.483 -176.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.15 51.23 2.45 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.306 -174.729 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 49.7 mt -109.46 142.79 39.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.914 0.387 . . . . 0.0 110.201 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.457 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 16.9 t70 -136.1 138.93 28.7 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.377 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 81' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 48.7 Cg_exo -60.95 16.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.631 2.887 . . . . 0.0 114.549 -175.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.453 ' HG2' ' OD2' ' B' ' 80' ' ' ASP . 0.2 OUTLIER -107.68 -6.38 16.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 174.932 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 83' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 28.6 mttm -103.86 143.85 27.49 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.986 -175.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.913 ' HG2' HG12 ' B' ' 40' ' ' ILE . 8.4 Cg_endo -83.12 141.01 10.19 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 C-N-CA 122.98 2.453 . . . . 0.0 111.108 174.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.0 OUTLIER -140.45 146.79 23.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.43 -178.324 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.509 ' CG1' HD21 ' B' ' 34' ' ' LEU . 2.2 p -124.79 140.3 48.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 87' ' ' VAL . . . . . 0.877 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 4.2 m -107.23 125.51 63.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.656 -177.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 88' ' ' PHE . . . . . 0.928 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.7 t80 -99.85 150.24 22.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.354 -178.205 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 89' ' ' CYS . . . . . 0.634 ' SG ' ' HG3' ' B' ' 46' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.392 0 CA-C-O 121.459 0.647 . . . . 0.0 111.701 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 95' ' ' ALA . . . . . 0.877 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.527 0.081 0 CA-C-O 120.819 0.343 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.34 -32.69 66.98 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.145 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -71.35 -27.9 63.69 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.079 0.466 . . . . 0.0 110.81 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 98' ' ' ALA . . . . . 0.415 ' HB1' HD22 ' B' ' 70' ' ' LEU . . . -73.47 -44.58 57.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.931 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -87.05 -40.93 6.84 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.782 -174.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 100' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -66.6 -29.54 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.004 0.402 . . . . 0.0 111.295 -174.883 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 101' ' ' THR . . . . . 0.473 ' HA ' ' HG3' ' B' ' 104' ' ' GLU . 8.0 m -72.74 -35.66 67.57 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.939 0.4 . . . . 0.0 111.127 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 102' ' ' LEU . . . . . 0.672 HD21 HD21 ' B' ' 74' ' ' LEU . 11.2 mt -66.61 -37.01 83.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 103' ' ' ARG . . . . . 0.574 ' HD3' ' O ' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -67.03 -25.07 66.09 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 179.194 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.473 ' HG3' ' HA ' ' B' ' 101' ' ' THR . 2.5 mt-10 -68.73 -6.6 27.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.23 174.696 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 105' ' ' TYR . . . . . 0.489 ' CE1' ' HB ' ' A' ' 10' ' ' THR . 17.2 m-85 -110.18 -11.2 14.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.68 0.276 . . . . 0.0 110.744 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 97.75 60.47 0.93 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.349 -0.929 . . . . 0.0 113.2 174.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 107' ' ' PHE . . . . . 0.532 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.1 m-85 -92.46 158.16 16.18 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.745 -0.268 . . . . 0.0 110.291 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -61.26 -70.27 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.535 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.6 113.97 9.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 178.283 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 110' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.3 tt -113.06 123.5 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.625 0.726 . . . . 0.0 110.936 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 111' ' ' TYR . . . . . 0.415 ' O ' ' HA ' ' B' ' 86' ' ' VAL . 1.3 m-85 -113.99 146.81 39.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.271 -176.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -111.33 138.67 47.52 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.496 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 8.4 m -87.57 111.84 21.64 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.982 0.42 . . . . 0.0 112.038 -174.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.408 ' HG2' ' SD ' ' B' ' 24' ' ' MET . 0.8 OUTLIER -63.21 148.28 48.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.253 177.081 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 85.38 -109.23 3.29 Favored Glycine 0 N--CA 1.442 -0.95 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.175 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 162.57 -157.77 29.79 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -60.6 -33.89 73.41 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.122 0.486 . . . . 0.0 110.144 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.585 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.52 -34.5 74.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.854 179.294 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 119' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -72.74 -32.38 65.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.535 0.207 . . . . 0.0 111.384 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 120' ' ' TRP . . . . . 0.759 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 20.2 t-105 -64.39 -54.63 29.78 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.84 -43.41 98.86 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.499 0.19 . . . . 0.0 111.163 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.585 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.6 OUTLIER -63.09 -33.08 74.69 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.898 -176.252 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 123' ' ' GLU . . . . . 0.599 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -82.96 -3.91 57.67 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.992 -177.28 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.18 27.75 73.6 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.672 -178.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.599 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 70.1 mt -72.47 161.97 76.36 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.273 . . . . 0.0 110.283 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.597 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 21.8 Cg_endo -57.21 108.68 0.38 Allowed 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.851 2.367 . . . . 0.0 111.642 178.51 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.63 149.99 51.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 2.7 mt . . . . . 0 C--N 1.318 -0.767 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.694 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.1 mmt . . . . . 0 C--O 1.232 0.183 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.659 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -52.16 -26.57 20.92 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 114.39 -1.277 . . . . 0.0 113.214 -179.195 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -33.27 57.62 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.542 ' HG3' ' N ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -61.29 -46.57 89.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.395 . . . . 0.0 112.001 -174.845 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.659 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 1.8 p90 -91.52 -20.51 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.821 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.51 -50.57 65.13 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 110.911 -177.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.71 -32.11 73.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.513 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -42.68 72.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.495 178.446 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.608 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.1 OUTLIER -56.82 -38.27 72.36 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.144 0.497 . . . . 0.0 110.152 176.435 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -32.17 73.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.652 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.32 -45.33 32.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.763 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -68.86 -51.45 40.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.657 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.3 t -61.97 -34.13 61.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.945 -176.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -58.7 -35.24 72.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.552 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -28.99 69.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 111.217 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.7 -31.75 61.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.622 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.54 ' HG3' ' SD ' ' A' ' 24' ' ' MET . 0.6 OUTLIER -76.9 -24.02 52.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.664 0.745 . . . . 0.0 110.119 173.74 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.9 -17.4 53.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.676 -178.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.602 ' HB3' ' HB2' ' A' ' 100' ' ' LYS . 0.4 OUTLIER -86.58 19.04 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -175.634 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.443 ' SD ' ' HA ' ' A' ' 96' ' ' ALA . 0.1 OUTLIER -149.35 157.68 43.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.537 178.197 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -75.7 103.05 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.179 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.574 ' SD ' ' HG2' ' A' ' 114' ' ' GLU . 1.4 mmt -72.07 125.9 28.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.693 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -141.65 152.58 44.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.322 -178.033 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 139.8 37.13 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.774 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -50.46 -19.38 4.72 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.578 2.852 . . . . 0.0 113.982 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -46.01 51.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.848 0.356 . . . . 0.0 111.066 176.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.49 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 1.2 t70 -77.39 -29.32 53.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.971 0.415 . . . . 0.0 110.458 178.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.94 -36.25 77.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.43 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -74.38 -39.76 62.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.777 -177.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 29' ' ' ASP . 2.4 pttt -63.08 -41.08 99.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.98 -0.288 . . . . 0.0 111.592 -174.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.536 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -74.19 -26.19 60.13 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.764 0.316 . . . . 0.0 110.612 176.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.698 HD11 ' HB2' ' A' ' 42' ' ' LEU . 4.6 mt -61.16 -54.43 44.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.408 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -75.8 -28.32 58.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.547 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.528 ' HG2' ' HA ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -84.6 -22.65 29.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.825 0.345 . . . . 0.0 111.158 -176.166 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -121.05 106.83 38.37 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.209 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -67.69 -0.94 5.89 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.817 2.345 . . . . 0.0 112.288 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.49 -25.33 15.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.066 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.624 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 53.6 mt -84.84 111.5 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.067 176.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.728 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -106.71 144.91 32.68 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.967 -176.647 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 1.0 HD11 ' HB2' ' A' ' 88' ' ' PHE . 25.8 tp -101.94 125.97 48.74 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.464 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 4.1 mt -108.96 106.24 20.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.176 174.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.784 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 3.6 t0 -83.2 125.18 31.28 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.674 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -110.31 97.19 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.603 0.716 . . . . 0.0 109.122 -178.731 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.55 ' HD2' ' SD ' ' A' ' 117' ' ' MET . 0.0 OUTLIER -162.51 -164.27 1.0 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.405 -176.0 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.484 ' CG ' HH12 ' B' ' 46' ' ' ARG . 11.7 m-20 -119.92 143.87 36.18 Favored Pre-proline 0 C--N 1.325 -0.472 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -177.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -65.68 -24.34 55.3 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 123.064 2.509 . . . . 0.0 114.194 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.82 -48.06 34.09 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.359 -176.683 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -27.35 64.56 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.137 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.28 -43.3 99.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.943 173.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -59.97 -35.95 76.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.578 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.15 -37.31 23.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.336 -175.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.3 mmm -100.47 -34.4 9.95 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -173.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 119.19 169.01 14.2 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 121.138 -0.553 . . . . 0.0 112.059 -178.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.475 ' HG3' ' HB2' ' A' ' 128' ' ' LEU . 6.2 pttt -138.3 158.07 71.44 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HB3' ' CZ2' ' A' ' 120' ' ' TRP . 19.8 Cg_exo -68.2 133.87 29.86 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.315 2.01 . . . . 0.0 113.137 -176.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.638 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 21.3 t0 -97.13 86.42 3.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 176.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.584 HG22 ' HB2' ' A' ' 62' ' ' TYR . 6.5 m -133.28 159.66 42.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.307 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.928 -175.199 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.517 ' HB3' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -116.99 84.34 2.13 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.902 0.382 . . . . 0.0 110.737 -177.302 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.784 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 5.8 t80 -125.51 126.94 45.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.401 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.728 ' HE2' HG21 ' A' ' 41' ' ' THR . 8.5 mttm -127.34 126.88 43.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.231 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -96.59 120.96 37.86 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.503 0.192 . . . . 0.0 110.668 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.738 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.365 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 177.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.738 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.702 ' HG3' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -53.51 -42.76 93.58 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.455 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.702 ' HD3' ' HG3' ' A' ' 71' ' ' GLU . 9.7 Cg_exo -71.95 -18.06 28.13 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.573 1.516 . . . . 0.0 111.856 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -97.6 -21.81 16.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.81 -176.746 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.677 HD21 HD21 ' A' ' 102' ' ' LEU . 15.3 tp -55.14 -56.63 17.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.971 -177.01 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.33 -19.91 64.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.039 -175.111 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -85.2 -12.26 53.07 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.51 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 20.3 m -105.42 35.9 2.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -173.098 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.04 56.98 5.0 Favored Glycine 0 C--N 1.335 0.474 0 O-C-N 123.365 0.415 . . . . 0.0 113.526 174.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.522 HD23 ' HA ' ' A' ' 79' ' ' LEU . 4.6 mt -109.19 140.98 42.09 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.769 0.319 . . . . 0.0 110.79 -178.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.55 154.64 76.89 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -68.74 2.67 2.79 Favored 'Trans proline' 0 CA--C 1.529 0.231 0 C-N-CA 122.802 2.335 . . . . 0.0 113.752 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.9 26.09 10.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.368 0.604 . . . . 0.0 110.176 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.8 mmtm -107.26 115.94 58.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -178.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.624 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 5.8 Cg_exo -74.06 103.75 1.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.574 2.182 . . . . 0.0 109.951 173.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.546 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 15.6 m -123.16 154.91 28.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.468 0.652 . . . . 0.0 111.79 -171.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.447 ' O ' HD12 ' A' ' 42' ' ' LEU . 1.4 p -122.68 145.48 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.766 174.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 43' ' ' ILE . 5.2 m -110.1 129.78 64.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 1.0 ' HB2' HD11 ' A' ' 42' ' ' LEU . 5.2 t80 -104.87 133.66 49.3 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.176 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' CYS . . . . . 0.481 ' HB3' ' HB2' ' A' ' 95' ' ' ALA . 35.5 t . . . . . 0 C--O 1.234 0.283 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.674 ' HA ' HG21 ' A' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.468 0.473 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.443 ' HA ' ' SD ' ' A' ' 22' ' ' MET . . . -57.1 -36.94 71.23 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.73 -35.33 77.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.525 0.202 . . . . 0.0 111.175 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.474 ' HB2' HD22 ' A' ' 70' ' ' LEU . . . -75.01 -53.44 8.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.124 0.488 . . . . 0.0 110.926 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.44 -53.97 25.77 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.719 -175.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -62.88 -37.33 86.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.682 0.277 . . . . 0.0 111.176 -173.192 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.529 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 11.0 m -72.43 -39.52 67.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.677 HD21 HD21 ' A' ' 74' ' ' LEU . 11.7 mt -64.83 -47.7 77.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.689 0.28 . . . . 0.0 111.422 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.813 ' HA ' ' HB2' ' A' ' 107' ' ' PHE . 1.7 ptm180 -63.6 -27.08 68.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.102 0.477 . . . . 0.0 110.734 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.73 -5.42 25.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.232 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -110.68 -6.64 14.78 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.197 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.56 31.62 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.919 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.813 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 2.3 m-85 -81.56 142.5 32.77 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.436 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.1 tttt -62.88 -87.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.445 -176.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.436 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -116.45 120.88 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.371 -177.2 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.546 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 0.5 OUTLIER -125.52 129.42 72.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -178.844 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -118.6 154.55 32.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.327 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -131.27 158.49 40.47 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -82.09 139.14 34.59 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.113 0.482 . . . . 0.0 111.478 -176.31 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.574 ' HG2' ' SD ' ' A' ' 24' ' ' MET . 0.0 OUTLIER -99.68 18.81 17.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 176.595 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.76 -75.73 0.16 Allowed Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.928 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 150.34 174.86 21.88 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.014 -0.613 . . . . 0.0 111.96 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' MET . . . . . 0.55 ' SD ' ' HD2' ' A' ' 46' ' ' ARG . 19.7 ttm -64.9 -36.37 84.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.419 0.628 . . . . 0.0 109.753 176.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -64.38 -27.78 69.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.044 177.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -69.37 -32.44 71.48 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 116.791 -0.186 . . . . 0.0 111.107 -179.165 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.675 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 27.8 t-105 -56.2 -52.29 64.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.569 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.417 ' HA ' HD23 ' A' ' 121' ' ' LEU . 3.3 mt -66.03 -40.86 91.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.444 178.256 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -68.13 -43.07 79.17 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.725 -175.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 119' ' ' LYS . 65.1 mt-10 -69.69 -18.12 63.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.763 0.316 . . . . 0.0 110.816 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 93.65 25.04 19.21 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.488 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.2 mt -80.45 152.46 73.05 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.638 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 13.8 Cg_endo -56.32 120.89 9.06 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 123.154 2.569 . . . . 0.0 112.286 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.63 157.29 45.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.469 -177.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.475 ' HB2' ' HG3' ' A' ' 56' ' ' LYS . 2.9 mt -110.62 101.66 10.3 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.09 178.452 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.322 -0.626 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 120.758 0.313 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 4' ' ' GLY . . . . . 0.67 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -56.46 -27.07 53.25 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.469 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -74.61 -33.92 62.72 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.892 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.498 ' HG3' ' N ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -64.59 -47.05 80.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.872 -174.793 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.67 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 11.8 p90 -84.44 -24.26 29.6 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.38 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.85 -48.37 70.04 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.788 -178.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.23 -43.61 98.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.407 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -43.09 99.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.736 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' PHE . . . . . 0.566 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 2.1 t80 -56.48 -41.24 76.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.292 0.568 . . . . 0.0 110.339 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' LYS . . . . . 0.653 ' HD2' ' HB2' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.87 -26.97 67.88 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.756 179.361 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.81 -40.57 61.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.075 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -71.28 -50.43 32.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.317 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -33.45 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.146 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -66.79 -40.19 88.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.794 0.33 . . . . 0.0 111.268 178.026 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.54 -26.32 68.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.447 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.8 71.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.6 -178.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -21.35 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.03 0.443 . . . . 0.0 111.092 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.0 -19.65 62.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.33 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.403 ' OD1' ' HD3' ' B' ' 103' ' ' ARG . 2.6 t70 -78.42 -9.26 59.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.953 0.406 . . . . 0.0 111.345 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' MET . . . . . 0.588 ' HE1' ' HA3' ' B' ' 99' ' ' GLY . 11.8 mtp -116.93 165.7 13.03 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 122.212 -0.305 . . . . 0.0 110.998 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.53 111.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 174.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' MET . . . . . 0.685 ' HB3' ' HG3' ' B' ' 114' ' ' GLU . 0.7 OUTLIER -78.67 105.43 9.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.869 -175.109 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 25' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' B' ' 25' ' ' LEU . 0.5 OUTLIER -121.78 148.26 44.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.505 0.669 . . . . 0.0 111.333 -177.039 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.99 137.05 33.37 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.207 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -41.09 -31.65 0.86 Allowed 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 124.632 3.555 . . . . 0.0 115.388 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.647 ' HG3' ' OE1' ' B' ' 123' ' ' GLU . 13.5 mtmm -73.43 -40.86 63.9 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.41 0.55 . . . . 0.0 110.738 178.397 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -69.66 -34.91 74.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.151 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.1 -43.27 78.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.362 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' TYR . . . . . 0.437 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 73.2 t80 -67.07 -31.09 71.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.327 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 tptt -61.58 -52.73 63.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.825 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.533 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -72.26 -26.62 62.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 179.755 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.664 HD11 ' HB2' ' B' ' 42' ' ' LEU . 5.1 mt -59.55 -55.39 35.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.0 mm100 -74.1 -32.88 63.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.174 -175.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.98 -40.67 68.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.259 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -108.5 113.61 59.93 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.371 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.45 -3.61 12.16 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 0.0 112.913 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -103.89 -16.64 15.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.538 -178.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.533 HD12 ' HB2' ' B' ' 33' ' ' LEU . 16.3 mt -81.12 109.02 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-O 121.25 0.548 . . . . 0.0 109.927 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.673 HG21 ' HE2' ' B' ' 63' ' ' LYS . 97.0 m -97.68 142.59 29.29 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.262 -176.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.867 HD11 ' HB2' ' B' ' 88' ' ' PHE . 11.3 tp -103.8 126.45 50.94 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 169.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.85 118.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.793 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -95.16 126.45 40.5 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.619 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -115.63 97.77 6.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.677 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 46' ' ' ARG . . . . . 0.484 HH12 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -168.48 179.92 4.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.558 -177.738 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -98.68 154.79 37.3 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.237 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.28 -19.19 38.74 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.736 2.291 . . . . 0.0 113.452 -176.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -45.43 23.77 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.484 -178.006 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -30.63 63.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.67 -46.53 88.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.751 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.57 -31.83 71.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -85.06 -37.24 20.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 5.5 mtm -98.93 -19.51 17.29 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -172.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 98.77 165.62 30.47 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.729 -175.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -143.58 145.01 29.71 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' PRO . . . . . 0.458 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 13.8 Cg_endo -61.57 135.55 57.6 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.846 2.364 . . . . 0.0 112.724 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -112.32 84.24 1.94 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.378 178.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.488 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.5 m -121.69 167.22 15.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.381 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 mttm -60.43 -47.9 84.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -174.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.72 71.06 0.76 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.143 0.496 . . . . 0.0 110.906 -177.475 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 62' ' ' TYR . . . . . 0.793 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -114.92 131.59 56.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 177.239 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.673 ' HE2' HG21 ' B' ' 41' ' ' THR . 1.0 OUTLIER -133.8 126.84 31.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.261 0.553 . . . . 0.0 110.313 179.018 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -82.16 122.16 27.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.79 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 65' ' ' MET . . . . . 0.808 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.223 -177.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.596 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.423 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.475 ' HG3' ' H ' ' B' ' 71' ' ' GLU . 0.0 OUTLIER -50.2 -46.55 83.03 Favored Pre-proline 0 N--CA 1.474 0.755 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.483 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.459 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 34.1 Cg_exo -61.24 -18.55 59.29 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.969 1.779 . . . . 0.0 112.454 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.808 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -105.68 -21.14 13.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 0.0 110.52 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.577 HD21 HD21 ' B' ' 102' ' ' LEU . 9.7 tp -64.36 -33.32 75.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.536 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.65 -24.29 45.27 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.81 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 35.1 mtpt -86.69 -2.53 58.6 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -175.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 77' ' ' SER . . . . . 0.594 ' HB3' ' HD2' ' B' ' 63' ' ' LYS . 20.1 m -116.55 35.59 4.5 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 38.44 56.25 1.97 Allowed Glycine 0 C--N 1.338 0.661 0 O-C-N 123.626 0.579 . . . . 0.0 114.151 173.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 73.6 mt -103.25 140.04 37.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 0.0 110.542 -178.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.651 ' HB2' ' HG3' ' B' ' 83' ' ' LYS . 11.0 m-20 -126.06 140.71 37.59 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 81' ' ' PRO . . . . . 0.534 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 38.6 Cg_endo -66.16 6.34 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.812 2.342 . . . . 0.0 113.162 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.491 ' H ' ' HG3' ' B' ' 82' ' ' GLU . 0.9 OUTLIER -105.87 -7.02 18.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.942 0.401 . . . . 0.0 110.727 176.55 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 83' ' ' LYS . . . . . 0.651 ' HG3' ' HB2' ' B' ' 80' ' ' ASP . 3.0 mttp -96.13 133.22 25.42 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.837 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.486 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.9 Cg_exo -72.56 123.04 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.645 2.23 . . . . 0.0 111.382 176.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 25.6 m -128.5 155.53 40.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.85 0.357 . . . . 0.0 110.717 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.529 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 1.4 p -129.99 144.04 39.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 12.0 m -105.83 129.31 59.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.895 0.378 . . . . 0.0 110.433 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' PHE . . . . . 0.867 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.3 t80 -105.84 130.04 53.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.666 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 89' ' ' CYS . . . . . 0.663 ' HB3' ' HB2' ' B' ' 95' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.393 0 O-C-N 125.194 1.559 . . . . 0.0 107.087 -177.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 95' ' ' ALA . . . . . 0.663 ' HB2' ' HB3' ' B' ' 89' ' ' CYS . . . . . . . . 0 N--CA 1.463 0.203 0 CA-C-O 120.762 0.315 . . . . 0.0 111.31 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.59 75.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.255 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -68.22 -30.79 69.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.028 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.68 -38.39 54.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.707 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 99' ' ' GLY . . . . . 0.588 ' HA3' ' HE1' ' B' ' 22' ' ' MET . . . -96.61 -41.85 3.52 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.939 -171.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -24.6 67.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.011 0.434 . . . . 0.0 110.867 -176.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.86 -53.94 11.66 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.574 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 102' ' ' LEU . . . . . 0.577 HD21 HD21 ' B' ' 74' ' ' LEU . 32.2 mt -55.28 -44.6 75.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.797 -175.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 103' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.0 OUTLIER -64.96 -31.17 72.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 110.811 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -75.52 -6.71 51.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.222 176.113 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 105' ' ' TYR . . . . . 0.608 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 16.5 m-30 -99.91 -11.36 20.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.953 0.406 . . . . 0.0 110.132 177.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.09 25.75 2.2 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.096 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 107' ' ' PHE . . . . . 0.595 ' HB2' ' HA ' ' B' ' 103' ' ' ARG . 2.3 m-85 -76.09 152.0 36.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 0.0 110.661 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -75.55 -77.7 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.335 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.39 109.31 13.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.005 0.431 . . . . 0.0 110.931 -178.199 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 110' ' ' ILE . . . . . 0.457 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.8 tt -114.57 129.68 70.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.587 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 111' ' ' TYR . . . . . 0.529 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 4.1 m-85 -113.37 143.72 44.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.056 -174.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.512 ' HB3' ' HE3' ' B' ' 24' ' ' MET . 19.5 t-20 -113.68 140.3 48.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 173.387 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.444 ' OG ' ' HD1' ' B' ' 88' ' ' PHE . 15.7 m -83.01 108.32 16.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.816 0.341 . . . . 0.0 111.634 -176.17 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.685 ' HG3' ' HB3' ' B' ' 24' ' ' MET . 0.5 OUTLIER -71.99 30.16 0.05 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.645 -176.012 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 115' ' ' GLY . . . . . 0.555 ' HA3' ' HG2' ' B' ' 119' ' ' LYS . . . -145.1 -73.83 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.28 178.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 135.01 -177.63 19.17 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.675 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.89 -32.57 72.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.207 0.527 . . . . 0.0 110.812 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 30.0 p-10 -66.24 -28.85 69.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.936 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 119' ' ' LYS . . . . . 0.555 ' HG2' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -74.11 -33.21 63.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.301 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 120' ' ' TRP . . . . . 0.772 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 19.3 t-105 -58.93 -49.91 76.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.913 0.387 . . . . 0.0 110.314 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.1 mt -68.67 -36.86 79.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.972 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.7 OUTLIER -68.32 -44.53 75.19 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.943 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 123' ' ' GLU . . . . . 0.647 ' OE1' ' HG3' ' B' ' 28' ' ' LYS . 68.1 mt-10 -80.1 8.61 6.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -176.175 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.58 21.36 77.28 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.245 172.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.479 HD21 ' HG2' ' B' ' 28' ' ' LYS . 96.0 mt -79.75 158.92 72.52 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-O 120.708 0.289 . . . . 0.0 111.001 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.438 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 41.5 Cg_endo -65.51 107.8 1.09 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.878 2.385 . . . . 0.0 112.326 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.84 150.39 46.46 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.321 -0.634 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.434 ' HB2' ' HD2' ' B' ' 81' ' ' PRO . 1.4 mpp? . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 120.823 0.345 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.774 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -59.65 -39.41 95.13 Favored Glycine 0 C--O 1.226 -0.395 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.748 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -39.47 91.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.045 0.45 . . . . 0.0 110.532 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.4 -55.78 29.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.106 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.918 ' HE2' ' HD3' ' B' ' 81' ' ' PRO . 3.0 p90 -78.97 -22.84 45.04 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.71 -176.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.575 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 18.6 t70 -54.31 -45.54 72.62 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.476 0.485 . . . . 0.0 110.613 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.05 91.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.945 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.94 -41.72 96.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.069 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.494 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.9 OUTLIER -58.76 -45.73 89.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.072 178.921 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -66.04 -27.85 68.41 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.694 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.46 -39.78 62.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -72.66 -49.06 34.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.693 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.817 HG11 ' HG2' ' B' ' 71' ' ' GLU . 1.4 t -64.14 -34.08 66.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.605 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -67.3 -30.85 70.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.588 0.232 . . . . 0.0 111.085 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.84 -25.56 67.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.006 0.432 . . . . 0.0 110.904 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.6 -29.89 63.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.103 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.35 -23.35 50.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.196 0.522 . . . . 0.0 110.836 174.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.82 -19.9 36.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.976 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.19 -21.9 66.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.155 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.607 ' HG3' ' HB2' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -138.24 -174.88 3.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.996 0.427 . . . . 0.0 111.621 -177.527 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.7 t -87.22 112.95 23.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.08 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.48 114.1 19.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.44 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -121.61 143.08 49.52 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 -177.25 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -73.97 140.14 77.07 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.893 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.407 ' HB3' ' HE3' ' A' ' 120' ' ' TRP . 2.0 Cg_endo -43.28 -36.27 6.11 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 124.232 3.288 . . . . 0.0 114.773 -175.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -41.26 61.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.927 0.394 . . . . 0.0 111.216 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -30.1 70.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.253 177.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.449 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.47 -45.69 52.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.604 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.737 ' HA ' HD12 ' A' ' 34' ' ' LEU . 60.4 t80 -63.38 -31.87 73.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.822 0.344 . . . . 0.0 111.097 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -56.87 -52.97 63.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.306 -178.649 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -70.4 -26.51 63.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.029 178.56 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.737 HD12 ' HA ' ' A' ' 31' ' ' TYR . 75.1 mt -64.34 -46.64 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.029 0.442 . . . . 0.0 111.008 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.726 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 1.2 pp0? -75.98 -29.51 58.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.572 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.63 -25.38 23.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -177.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -122.53 97.42 44.7 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.74 0.48 4.2 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.021 2.481 . . . . 0.0 112.818 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -95.43 -23.59 17.07 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 51.1 mt -80.07 112.38 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.172 173.015 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.732 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.2 OUTLIER -105.56 145.71 30.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.356 -174.192 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.984 HD11 ' HB2' ' A' ' 88' ' ' PHE . 4.3 tp -102.3 128.24 48.94 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -108.55 117.09 53.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 175.574 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.842 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.9 OUTLIER -105.4 138.13 42.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.224 -175.226 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.67 98.59 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.074 175.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.672 ' HD3' ' HG3' ' A' ' 117' ' ' MET . 0.2 OUTLIER -144.62 147.63 33.34 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.331 -176.881 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 1.362 ' CG ' HH11 ' B' ' 46' ' ' ARG . 70.5 m-20 -62.21 136.11 95.34 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 123.392 0.432 . . . . 0.0 111.086 -177.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -61.6 -31.38 86.94 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.07 2.514 . . . . 0.0 113.1 -177.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -78.37 -36.6 45.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.761 ' HB2' ' CG ' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -67.94 -34.53 76.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.36 175.355 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.615 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 tp -57.9 -34.59 69.98 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.418 0.628 . . . . 0.0 110.315 176.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -75.74 -39.1 57.77 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.763 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.88 -48.25 11.77 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 mtm -97.54 -36.61 10.25 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.595 -174.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.28 172.79 13.53 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.248 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.615 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -136.11 152.06 74.73 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -61.42 126.04 18.28 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.088 1.859 . . . . 0.0 112.769 -177.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.614 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 63.5 t0 -87.71 87.93 7.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.283 175.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.96 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -123.27 144.91 31.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.79 179.354 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.726 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.69 -42.14 71.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.036 -176.868 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.732 ' HB2' HG23 ' A' ' 41' ' ' THR . 7.3 p30 -114.47 72.97 0.8 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.25 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.96 ' HB2' HG23 ' A' ' 59' ' ' VAL . 7.5 t80 -97.47 117.91 32.78 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.474 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.62 ' HE2' HG21 ' A' ' 41' ' ' THR . 6.4 mtmm -117.97 110.83 18.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.962 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -83.5 116.3 22.48 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.937 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.54 0 CA-C-O 120.997 0.427 . . . . 0.0 110.989 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.937 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.586 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -45.38 -56.52 9.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.888 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.632 ' O ' ' HG3' ' A' ' 76' ' ' LYS . 11.5 Cg_exo -72.92 -18.32 24.53 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.898 1.732 . . . . 0.0 113.026 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.731 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 1.0 OUTLIER -90.44 -16.42 29.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.042 0.449 . . . . 0.0 110.384 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.645 HD13 HD11 ' A' ' 70' ' ' LEU . 42.1 tp -68.11 -35.87 78.84 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.134 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.42 -31.21 53.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.329 175.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.632 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 3.0 mttm -70.08 -25.09 63.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.912 -176.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.92 -44.74 13.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.946 0.403 . . . . 0.0 110.634 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.52 58.0 0.97 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.776 -0.726 . . . . 0.0 111.598 -176.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.609 ' HB3' ' HZ ' ' A' ' 107' ' ' PHE . 7.4 mt -91.6 145.02 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.604 0.24 . . . . 0.0 110.467 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -122.15 140.15 31.85 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -67.37 5.56 0.89 Allowed 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.881 2.388 . . . . 0.0 114.371 -173.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -101.85 -11.41 19.06 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.779 -0.575 . . . . 0.0 110.437 175.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.8 mptp? -87.9 119.96 70.66 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.257 -179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.675 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 12.5 Cg_exo -67.68 133.46 29.74 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.683 2.255 . . . . 0.0 111.086 176.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 3.8 m -136.19 155.57 35.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.047 0.451 . . . . 0.0 111.213 -177.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 p -124.68 141.86 43.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.269 176.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.822 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 3.6 m -107.95 143.34 18.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.984 ' HB2' HD11 ' A' ' 42' ' ' LEU . 5.7 t80 -123.21 139.2 54.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -174.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 124.416 1.086 . . . . 0.0 111.974 -179.929 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.822 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.531 0.213 0 CA-C-O 120.889 0.376 . . . . 0.0 111.335 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.41 -34.64 72.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.21 -32.31 70.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.14 -38.14 61.13 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.644 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.41 -44.8 3.64 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.704 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -61.5 -24.85 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.8 0.333 . . . . 0.0 110.854 -174.844 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.0 -50.75 26.1 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-O 121.359 0.599 . . . . 0.0 110.713 175.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 102' ' ' LEU . 14.5 mt -55.05 -39.51 69.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.95 -173.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.49 -27.65 67.96 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.849 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 3.8 mt-10 -76.41 -7.78 55.76 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.024 0.44 . . . . 0.0 110.704 175.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.513 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 13.8 m-85 -103.65 -2.9 25.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.144 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 125.97 -12.15 7.28 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.232 -0.985 . . . . 0.0 113.685 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.609 ' HZ ' ' HB3' ' A' ' 79' ' ' LEU . 23.8 m-85 -59.44 111.8 1.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.082 0.467 . . . . 0.0 110.785 -177.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -66.97 -50.86 60.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.366 -171.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.675 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 1.8 m -121.54 101.99 7.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.195 0.522 . . . . 0.0 111.312 -174.675 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.3 tt -121.15 130.9 74.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.922 -176.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -112.77 141.76 46.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.591 -176.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.607 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 19.6 t-20 -113.09 144.21 43.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.576 ' OG ' ' HA ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -79.86 130.42 35.3 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -171.055 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -174.71 1.55 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.196 171.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.883 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 45.76 -104.14 0.06 OUTLIER Glycine 0 CA--C 1.518 0.249 0 O-C-N 123.413 0.445 . . . . 0.0 113.576 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -177.46 -163.11 28.84 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 177.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' MET . . . . . 0.672 ' HG3' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -71.93 -29.39 64.24 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.142 0.496 . . . . 0.0 109.978 176.939 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -33.56 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.87 178.134 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.924 ' HA ' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -66.95 -32.05 73.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.612 -179.006 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.689 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -61.54 -54.66 40.25 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 16.6 mt -63.55 -42.83 98.36 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.92 0.391 . . . . 0.0 111.207 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.924 ' HG2' ' HA ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -70.45 -32.86 70.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.932 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.492 ' N ' ' HG3' ' A' ' 122' ' ' GLU . 19.0 mm-40 -80.65 3.4 22.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.41 25.05 76.13 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.214 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.459 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 60.5 mt -74.24 161.7 77.12 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.614 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 35.3 Cg_endo -61.03 115.32 2.63 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.516 2.144 . . . . 0.0 111.385 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.24 150.39 51.94 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.513 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 5.7 mt -102.92 102.3 12.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.059 0.457 . . . . 0.0 110.154 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.731 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' B' ' 6' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 4' ' ' GLY . . . . . 0.75 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.24 -44.57 96.37 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.689 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.98 -32.34 72.68 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.165 0.507 . . . . 0.0 110.888 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.576 ' HB2' ' HG3' ' B' ' 3' ' ' MET . 0.4 OUTLIER -71.55 -52.52 17.73 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.438 -174.491 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.75 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -83.81 -22.85 31.67 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.219 -176.185 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -53.24 -45.72 68.87 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.154 0.502 . . . . 0.0 109.989 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.26 -39.42 90.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.527 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.63 -46.74 62.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.451 0.167 . . . . 0.0 111.269 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' PHE . . . . . 0.513 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 0.4 OUTLIER -56.67 -43.17 80.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.411 0.624 . . . . 0.0 109.947 179.227 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 12' ' ' LYS . . . . . 0.597 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.7 OUTLIER -66.2 -26.39 67.37 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.486 176.544 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.89 -49.35 20.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.892 0.377 . . . . 0.0 111.124 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -62.91 -50.97 68.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.129 179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.41 -32.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.596 -175.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.597 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 6.3 ttmm -66.03 -40.76 91.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.583 0.23 . . . . 0.0 110.913 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.66 -27.01 62.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.485 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.85 -32.54 63.71 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.753 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -24.95 41.2 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.462 0.648 . . . . 0.0 110.702 172.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.04 -17.11 36.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.026 -0.988 . . . . 0.0 112.317 -175.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.585 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 8.4 t0 -69.05 -25.96 64.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.901 -174.115 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' MET . . . . . 0.63 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 5.8 ptm -119.73 176.68 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.847 0.356 . . . . 0.0 111.772 -176.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 41.2 t -74.17 111.97 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.916 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.1 109.36 15.59 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.854 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' LEU . . . . . 0.497 ' HA ' HD23 ' B' ' 25' ' ' LEU . 0.9 OUTLIER -119.52 146.04 45.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.317 0.58 . . . . 0.0 111.02 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.38 137.81 52.05 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.289 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 3.4 Cg_endo -48.24 -22.35 3.78 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 124.05 3.167 . . . . 0.0 114.419 -176.593 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 16.7 mtmm -73.26 -42.47 62.46 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.165 -0.334 . . . . 0.0 110.906 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.26 -32.89 49.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.147 0.498 . . . . 0.0 110.225 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' B' ' 27' ' ' PRO . . . -63.48 -47.89 79.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.268 177.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 31' ' ' TYR . . . . . 0.639 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 78.8 t80 -66.82 -33.39 75.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 177.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' B' ' 35' ' ' GLN . 9.0 tptp -56.92 -50.22 73.23 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.115 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.525 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -72.18 -26.3 62.01 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.727 177.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' B' ' 31' ' ' TYR . 18.4 mt -63.45 -51.04 67.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.858 0.361 . . . . 0.0 111.183 178.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -71.22 -31.25 67.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.395 -177.304 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -82.06 -38.29 25.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.822 0.344 . . . . 0.0 111.765 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -110.04 108.54 59.06 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.909 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.33 0.1 7.89 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.671 2.248 . . . . 0.0 111.759 176.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.22 -29.65 14.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.071 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.568 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 61.2 mt -82.63 109.43 16.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.948 177.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -102.23 143.57 31.85 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.798 -177.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.931 HD11 ' HB2' ' B' ' 88' ' ' PHE . 5.8 tp -100.19 127.9 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 174.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.416 HG12 ' CE ' ' B' ' 65' ' ' MET . 2.0 mt -109.13 118.3 56.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-O 121.235 0.54 . . . . 0.0 109.669 177.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.768 ' HB3' ' CE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -104.64 133.32 49.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.528 -0.76 . . . . 0.0 108.951 178.378 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.866 HG11 HD22 ' B' ' 70' ' ' LEU . 27.6 m -131.61 99.52 3.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.034 -0.985 . . . . 0.0 109.974 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 46' ' ' ARG . . . . . 1.362 HH11 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -153.93 165.27 36.64 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.614 -1.175 . . . . 0.0 109.36 -176.668 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 1.203 ' HB3' ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -66.51 129.86 94.13 Favored Pre-proline 0 C--N 1.316 -0.885 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.102 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 48' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' B' ' 52' ' ' LYS . 26.3 Cg_endo -68.72 -16.7 42.24 Favored 'Trans proline' 0 N--CA 1.474 0.349 0 C-N-CA 123.689 2.926 . . . . 0.0 114.843 -168.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.467 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . 0.4 OUTLIER -78.12 -46.62 20.19 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -173.531 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -71.2 -33.53 70.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 0.0 110.365 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.53 -44.39 97.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.338 175.392 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 52' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' B' ' 48' ' ' PRO . 1.7 ttpt -63.69 -37.08 86.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.747 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -97.46 -44.85 6.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -171.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 1.9 mmm -90.28 -34.8 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.405 -0.518 . . . . 0.0 112.33 -171.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' GLY . . . . . 0.491 ' HA2' ' O ' ' B' ' 128' ' ' LEU . . . 149.72 145.05 4.05 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.077 -1.059 . . . . 0.0 113.764 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 56' ' ' LYS . . . . . 0.439 ' HG3' ' HB2' ' B' ' 128' ' ' LEU . 0.0 OUTLIER -133.9 165.07 39.48 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 174.67 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.11 129.37 17.11 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.576 1.518 . . . . 0.0 112.559 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 58' ' ' ASP . . . . . 0.605 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 13.4 t70 -90.37 95.33 10.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.311 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.604 HG23 ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -138.27 153.14 26.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.598 -174.191 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -34.24 70.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.312 -176.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -132.53 79.39 1.85 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.31 0.576 . . . . 0.0 111.867 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' TYR . . . . . 0.768 ' CE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -139.08 137.62 36.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.482 176.287 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -120.7 129.09 53.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.944 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -90.29 111.74 23.04 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' MET . . . . . 0.553 ' HG2' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.519 0 CA-C-O 120.541 0.21 . . . . 0.0 110.516 -176.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.866 HD22 HG11 ' B' ' 45' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.817 ' HG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -45.41 -63.97 1.05 Allowed Pre-proline 0 CA--C 1.547 0.837 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -174.417 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.573 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 61.8 Cg_endo -75.24 -12.78 21.05 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.349 2.033 . . . . 0.0 113.561 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.553 ' HB3' ' HG2' ' B' ' 65' ' ' MET . 0.1 OUTLIER -89.5 2.73 54.18 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.318 -0.239 . . . . 0.0 111.169 -174.895 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.95 HD21 HD21 ' B' ' 102' ' ' LEU . 8.7 tp -72.74 -52.86 13.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.344 -177.352 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -72.13 -19.68 61.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.733 0.302 . . . . 0.0 111.498 -177.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.65 -27.57 31.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.648 -175.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -77.95 -27.12 49.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -177.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.24 75.38 1.3 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.511 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 9.5 mt -129.59 145.23 51.5 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -128.03 138.47 33.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 81' ' ' PRO . . . . . 0.918 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 35.6 Cg_endo -69.21 12.48 0.28 Allowed 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.209 2.606 . . . . 0.0 114.245 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -102.77 -12.11 17.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 176.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 83' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -95.5 133.91 25.09 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.279 -177.274 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.568 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.7 Cg_exo -71.65 126.8 12.42 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.429 2.086 . . . . 0.0 110.839 175.241 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 6.3 m -132.11 151.88 35.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.534 -176.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 1.6 p -125.62 141.78 44.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 87' ' ' VAL . . . . . 0.825 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 16.6 m -107.73 141.03 23.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 88' ' ' PHE . . . . . 0.931 ' HB2' HD11 ' B' ' 42' ' ' LEU . 8.9 t80 -119.12 141.48 48.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.034 -173.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 89' ' ' CYS . . . . . 0.589 ' HB2' ' O ' ' B' ' 88' ' ' PHE . 1.4 m . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 123.618 0.767 . . . . 0.0 111.754 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 95' ' ' ALA . . . . . 0.825 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.458 -0.051 0 CA-C-O 121.047 0.451 . . . . 0.0 110.625 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.52 -33.58 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.69 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.07 -29.75 70.14 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.602 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 98' ' ' ALA . . . . . 0.425 ' HB2' HD21 ' B' ' 70' ' ' LEU . . . -75.88 -56.04 5.05 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.293 0.568 . . . . 0.0 110.685 176.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 99' ' ' GLY . . . . . 0.42 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -71.74 -48.63 27.32 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.023 -0.99 . . . . 0.0 114.464 -171.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 100' ' ' LYS . . . . . 0.585 ' HB2' ' HB3' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -68.41 -33.71 74.72 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.497 -0.413 . . . . 0.0 111.107 -174.154 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 101' ' ' THR . . . . . 0.409 HG22 ' CE2' ' B' ' 105' ' ' TYR . 6.2 m -72.07 -36.01 69.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.656 0.265 . . . . 0.0 110.889 176.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 102' ' ' LEU . . . . . 0.95 HD21 HD21 ' B' ' 74' ' ' LEU . 8.9 mt -64.18 -47.75 78.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.446 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 103' ' ' ARG . . . . . 0.486 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.6 OUTLIER -65.1 -26.99 68.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.791 0.329 . . . . 0.0 110.597 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 2.9 mt-10 -73.11 -6.79 48.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.33 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 105' ' ' TYR . . . . . 0.409 ' CE2' HG22 ' B' ' 101' ' ' THR . 22.0 m-30 -106.07 -8.37 17.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.961 0.41 . . . . 0.0 110.284 175.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 109.28 60.92 0.52 Allowed Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.49 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 107' ' ' PHE . . . . . 0.66 ' CE1' HD22 ' B' ' 102' ' ' LEU . 1.3 m-85 -104.48 139.61 39.15 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 176.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 -77.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.498 0.499 . . . . 0.0 111.522 -175.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.503 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 2.7 m -129.94 109.05 10.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.141 0.495 . . . . 0.0 111.238 -178.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 110' ' ' ILE . . . . . 0.563 HG12 ' HE3' ' B' ' 22' ' ' MET . 2.3 tt -115.77 130.33 70.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.672 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -114.6 146.85 40.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.45 -177.008 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.63 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 7.0 t-20 -111.27 138.4 47.79 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 172.098 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.508 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 65.5 m -87.83 112.64 22.68 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -62.06 145.76 52.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.966 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.75 -110.6 3.32 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.434 -0.889 . . . . 0.0 111.624 -174.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 116' ' ' GLY . . . . . 0.492 ' H ' ' HB2' ' B' ' 119' ' ' LYS . . . 160.37 -162.5 33.35 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.88 -36.19 74.24 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.011 0.434 . . . . 0.0 110.699 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 3.5 t70 -61.85 -35.06 77.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.406 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 119' ' ' LYS . . . . . 0.539 ' O ' ' HG2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -74.01 -33.42 63.78 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.806 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 120' ' ' TRP . . . . . 0.925 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 25.9 t-105 -57.6 -52.96 63.28 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.59 -39.84 95.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.024 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -70.67 -35.15 72.7 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 112.341 0.496 . . . . 0.0 112.341 -174.966 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 123' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 19.1 mm-40 -74.83 -4.24 36.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.813 0.34 . . . . 0.0 110.519 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.07 23.85 73.23 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.705 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.49 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 72.4 mt -76.67 160.78 76.25 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.49 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 29.5 Cg_endo -61.39 108.26 0.58 Allowed 'Trans proline' 0 C--O 1.236 0.397 0 C-N-CA 122.35 2.033 . . . . 0.0 111.221 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.71 156.01 43.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.714 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 128' ' ' LEU . . . . . 0.605 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 8.4 mt . . . . . 0 C--N 1.318 -0.796 0 CA-C-O 120.897 0.38 . . . . 0.0 110.398 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.827 0.346 . . . . 0.0 111.304 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.651 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -49.98 -23.45 5.48 Favored Glycine 0 CA--C 1.522 0.493 0 CA-C-N 115.127 -0.942 . . . . 0.0 114.061 -174.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -73.78 -32.68 63.9 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -64.07 -47.38 80.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -173.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.651 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.3 p90 -91.1 -23.19 20.38 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.967 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.654 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 2.9 t70 -53.59 -54.92 30.69 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.852 0.358 . . . . 0.0 110.629 -178.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.96 -42.24 89.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.526 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' THR . . . . . 0.518 ' HB ' ' CZ ' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -68.91 -44.98 72.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.41 -178.505 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.559 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.6 OUTLIER -57.93 -47.41 82.94 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.253 0.549 . . . . 0.0 110.074 -179.377 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.517 ' HD2' ' HD2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -64.76 -26.29 68.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.107 177.127 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.13 -40.78 64.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.883 0.373 . . . . 0.0 111.392 178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -72.36 -49.88 30.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.793 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 t -62.07 -36.47 74.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.303 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HD2' ' HD2' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -64.14 -30.05 71.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.566 0.222 . . . . 0.0 111.49 179.558 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.02 68.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 110.687 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.439 ' HB1' ' HB1' ' A' ' 96' ' ' ALA . . . -73.62 -30.13 62.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.397 177.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -77.02 -24.15 52.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.528 0.68 . . . . 0.0 110.302 172.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.86 35.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.981 -1.008 . . . . 0.0 111.234 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -71.03 -24.21 62.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.787 -175.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.864 ' HE3' ' HA3' ' A' ' 99' ' ' GLY . 14.5 mtp -121.23 178.47 4.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.691 0.282 . . . . 0.0 111.158 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.7 112.45 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.541 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -78.28 103.19 8.06 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.174 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' A' ' 25' ' ' LEU . 3.2 mt -112.08 139.62 47.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.979 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.39 147.77 57.35 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.897 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.532 ' HB3' ' CE3' ' A' ' 120' ' ' TRP . 26.9 Cg_exo -34.18 -56.42 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.536 3.49 . . . . 0.0 114.394 -175.408 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.601 ' HG3' ' OE1' ' A' ' 123' ' ' GLU . 4.4 mttp -63.37 -37.82 88.76 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.069 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.51 -34.91 76.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 0.0 110.343 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.621 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -71.79 -47.37 53.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.518 176.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.597 ' HA ' HD12 ' A' ' 34' ' ' LEU . 82.6 t80 -60.02 -32.25 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.351 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.73 -51.87 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.438 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -74.31 -27.16 60.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.033 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 30' ' ' ALA . 81.6 mt -62.98 -55.35 26.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.989 0.423 . . . . 0.0 111.263 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.684 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -75.85 -22.27 56.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.071 -173.601 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.72 -24.29 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.883 0.373 . . . . 0.0 110.791 -177.15 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -129.49 94.11 33.54 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.288 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HA ' ' ND2' ' A' ' 61' ' ' ASN . 40.8 Cg_endo -68.81 9.58 0.44 Allowed 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.73 2.287 . . . . 0.0 113.103 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -91.12 -29.17 17.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.614 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 26.2 mt -83.16 100.91 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.458 173.092 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.66 HG21 ' HE2' ' A' ' 63' ' ' LYS . 9.9 m -92.61 146.8 23.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.401 -175.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.966 HD11 ' HB2' ' A' ' 88' ' ' PHE . 8.3 tp -100.74 128.3 46.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 173.253 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.418 HG23 ' SD ' ' A' ' 65' ' ' MET . 13.1 mt -109.59 118.15 56.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.442 177.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.852 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -102.39 124.02 47.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.225 0.536 . . . . 0.0 109.869 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -109.26 96.68 4.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.429 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.7 ' HA ' ' NE ' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -150.06 163.33 38.45 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.294 -176.32 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' A' ' 50' ' ' GLU . 6.0 t70 -75.91 137.28 69.6 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.786 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -59.6 -29.95 91.13 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.677 2.251 . . . . 0.0 112.367 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.23 -36.23 47.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.809 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.58 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -65.88 -35.79 81.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 173.251 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.865 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.0 OUTLIER -65.51 -33.67 76.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.734 177.232 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -42.08 61.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.648 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.06 -45.55 23.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -175.015 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.1 mtp -101.41 -34.7 9.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 116.41 179.14 18.05 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.56 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.865 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -148.23 155.7 43.09 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.108 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.475 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 23.4 Cg_endo -65.52 137.51 50.91 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.413 2.076 . . . . 0.0 112.598 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.69 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t0 -111.95 84.72 2.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.229 0.537 . . . . 0.0 110.595 178.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.776 HG22 ' HB2' ' A' ' 62' ' ' TYR . 13.0 m -112.02 163.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.005 176.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.684 ' HD2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.83 -42.94 72.53 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.634 0.584 . . . . 0.0 111.59 -177.546 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.409 ' ND2' ' HA ' ' A' ' 38' ' ' PRO . 27.6 p-10 -120.47 76.76 1.21 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.724 0.773 . . . . 0.0 111.206 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.852 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 2.4 t80 -116.99 125.97 52.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.431 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.66 ' HE2' HG21 ' A' ' 41' ' ' THR . 6.3 mttm -122.02 123.53 41.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.124 176.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.428 ' HB2' ' OH ' ' A' ' 62' ' ' TYR . 11.4 t-160 -94.64 132.93 38.85 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.628 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.662 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.66 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.628 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.489 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.833 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.8 mp0 -49.05 -60.1 5.28 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.708 -177.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.833 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 13.8 Cg_exo -71.26 -18.09 30.54 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.248 1.966 . . . . 0.0 113.124 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.482 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -88.69 -15.45 34.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.616 0.246 . . . . 0.0 111.414 -178.434 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.872 HD21 HD21 ' A' ' 102' ' ' LEU . 3.3 tp -57.88 -52.8 63.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.239 0.543 . . . . 0.0 110.507 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.572 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -68.14 -29.4 68.29 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.651 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 1.6 mtpt -75.69 -30.39 59.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.072 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.9 m -78.85 -38.01 38.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.92 90.5 2.13 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.389 177.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.3 mt -134.23 148.54 50.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.848 0.356 . . . . 0.0 111.084 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.47 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -134.45 138.25 29.67 Favored Pre-proline 0 C--N 1.328 -0.331 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.358 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 44.4 Cg_exo -63.88 -1.06 3.07 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.368 2.712 . . . . 0.0 114.608 -172.374 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.414 ' O ' ' HD2' ' A' ' 108' ' ' LYS . 12.7 mm-40 -97.1 -5.88 36.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.039 0.447 . . . . 0.0 110.15 175.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -92.82 116.0 65.8 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.295 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.614 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 17.1 Cg_exo -63.27 141.44 82.1 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.436 2.09 . . . . 0.0 110.411 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.482 HG23 HD12 ' A' ' 110' ' ' ILE . 0.5 OUTLIER -138.58 146.28 26.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 121.091 0.472 . . . . 0.0 111.384 -175.246 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.512 HG13 HD12 ' A' ' 42' ' ' LEU . 1.5 p -119.91 142.9 33.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 172.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 5.3 m -102.85 127.43 56.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.038 0.447 . . . . 0.0 110.732 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.966 ' HB2' HD11 ' A' ' 42' ' ' LEU . 3.7 t80 -113.47 151.95 30.78 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.5 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' CYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 88' ' ' PHE . 5.4 p . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.526 -176.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.231 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.439 ' HB1' ' HB1' ' A' ' 18' ' ' ALA . . . -59.28 -36.75 76.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.132 176.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -67.17 -36.8 82.56 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.824 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ALA . . . . . 0.64 ' HA ' ' HZ ' ' B' ' 11' ' ' PHE . . . -74.47 -47.96 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.46 . . . . 0.0 110.644 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.864 ' HA3' ' HE3' ' A' ' 22' ' ' MET . . . -69.77 -52.99 17.38 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.666 -0.697 . . . . 0.0 113.626 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.39 -30.7 71.79 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.66 -0.318 . . . . 0.0 111.372 -175.21 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.449 HG22 ' CE2' ' A' ' 105' ' ' TYR . 47.3 m -73.05 -37.95 66.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.362 . . . . 0.0 110.846 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.872 HD21 HD21 ' A' ' 74' ' ' LEU . 12.8 mt -64.2 -46.11 85.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.153 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.37 -26.49 68.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 110.349 177.553 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -72.98 -9.21 58.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.491 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.449 ' CE2' HG22 ' A' ' 101' ' ' THR . 20.9 m-85 -106.03 -18.46 14.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 0.0 110.6 177.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 117.04 54.95 0.31 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.875 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.522 ' CE1' HD22 ' A' ' 102' ' ' LEU . 1.1 m-85 -94.47 167.92 11.2 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.711 -0.287 . . . . 0.0 110.261 176.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.456 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.4 tttt -77.17 -98.37 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.83 0.348 . . . . 0.0 111.303 -176.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.456 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -107.04 121.71 45.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.524 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.482 HD12 HG23 ' A' ' 85' ' ' VAL . 1.0 OUTLIER -121.91 126.77 74.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.49 0.662 . . . . 0.0 111.477 -174.775 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.47 147.53 44.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.254 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -117.71 144.78 44.94 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.5 131.3 36.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.473 0.654 . . . . 0.0 111.348 -172.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.409 ' HA ' ' OE1' ' A' ' 114' ' ' GLU . 3.8 tp10 -98.2 3.8 48.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.511 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.82 -92.9 2.28 Favored Glycine 0 N--CA 1.443 -0.84 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.203 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 89' ' ' CYS . . . 141.32 161.44 8.71 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' MET . . . . . 0.547 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -56.97 -41.38 78.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.115 0.457 . . . . 0.0 110.954 -176.97 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.37 -27.61 65.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.424 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -72.65 -32.49 65.9 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.761 176.629 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.574 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 41.5 t-105 -56.99 -47.28 81.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.44 -38.22 86.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.753 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 119' ' ' LYS . 64.6 mt-10 -65.67 -37.3 86.12 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.558 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.601 ' OE1' ' HG3' ' A' ' 28' ' ' LYS . 15.5 mt-10 -83.58 4.08 29.81 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 70.48 28.8 70.61 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.344 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.482 HD21 ' HG2' ' A' ' 28' ' ' LYS . 71.7 mt -85.83 158.88 55.84 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-O 120.516 0.198 . . . . 0.0 110.513 -178.059 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.25 119.06 6.06 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.415 2.743 . . . . 0.0 112.564 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.4 m -133.19 158.31 43.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.032 0.444 . . . . 0.0 111.459 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.69 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 1.1 mt -113.97 111.31 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.295 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 . . . . . 0 C--N 1.319 -0.742 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.88 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 3' ' ' MET . . . . . 0.561 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mmm . . . . . 0 CA--C 1.52 -0.19 0 CA-C-O 120.673 0.273 . . . . 0.0 111.469 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' GLY . . . . . 0.698 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.45 -36.26 76.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.474 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.67 -32.29 73.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.857 0.361 . . . . 0.0 111.027 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -63.51 -48.12 78.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.994 -176.018 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.698 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.7 p90 -90.62 -22.46 21.2 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.192 -177.296 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ASP . . . . . 0.572 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -53.67 -47.43 70.41 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.986 0.422 . . . . 0.0 110.756 -177.153 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.9 -43.6 98.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.107 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.45 -42.57 92.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.522 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' PHE . . . . . 0.64 ' HZ ' ' HA ' ' A' ' 98' ' ' ALA . 0.2 OUTLIER -55.59 -50.41 70.16 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.006 0.431 . . . . 0.0 111.107 -176.797 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 12' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' B' ' 12' ' ' LYS . 20.9 tptt -69.68 -23.66 63.48 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.191 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.71 75.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -71.43 -50.14 34.78 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.229 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.73 -34.59 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.242 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -63.07 -31.97 73.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.529 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.32 -26.21 64.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 0.0 111.193 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.27 -45.6 83.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.702 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' B' ' 16' ' ' LYS . 1.1 ptmt -75.3 -21.01 58.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.099 0.476 . . . . 0.0 111.067 176.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -17.14 60.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.543 -178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.4 -19.73 60.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.92 0.391 . . . . 0.0 111.554 -177.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' MET . . . . . 0.729 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 2.6 ptm -120.86 -179.54 4.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.758 0.313 . . . . 0.0 110.916 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.34 106.71 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.109 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.41 103.56 4.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.186 0.517 . . . . 0.0 110.267 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' B' ' 25' ' ' LEU . 1.5 mt -116.0 141.35 48.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.885 -178.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.45 144.37 43.09 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.374 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.473 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 3.9 Cg_exo -40.68 -34.13 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 124.814 3.676 . . . . 0.0 115.402 -174.349 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.524 ' HE3' ' HB3' ' B' ' 123' ' ' GLU . 1.5 mttt -74.47 -44.04 53.38 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.672 0.669 . . . . 0.0 111.266 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.24 -33.38 75.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.247 0.546 . . . . 0.0 110.15 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.79 52.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.821 177.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' TYR . . . . . 0.557 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.6 t80 -63.96 -32.9 74.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.522 0.201 . . . . 0.0 111.037 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -54.59 -53.73 50.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.898 -179.741 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.461 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -74.78 -27.69 60.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.156 179.086 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.557 ' HB2' ' HA ' ' B' ' 31' ' ' TYR . 6.2 mt -62.45 -56.59 16.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.002 0.429 . . . . 0.0 111.418 -178.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -77.36 -21.71 52.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.222 -174.332 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -91.05 -27.94 18.28 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.578 -177.447 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -120.42 93.31 48.21 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' PRO . . . . . 0.511 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 31.5 Cg_exo -64.68 3.64 0.84 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 123.229 2.619 . . . . 0.0 114.067 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' B' ' 83' ' ' LYS . 20.4 t70 -92.18 -22.45 19.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.555 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 53.5 mt -78.31 107.66 10.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.751 174.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.534 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.6 OUTLIER -97.28 145.05 26.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.36 -175.95 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.886 HD11 ' HB2' ' B' ' 88' ' ' PHE . 11.1 tp -104.76 125.49 50.89 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.423 HD11 HD11 ' B' ' 79' ' ' LEU . 1.1 mp -102.33 116.61 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 175.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.754 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.72 121.5 41.76 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -176.445 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.39 96.48 4.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 46' ' ' ARG . . . . . 0.628 ' HA ' ' NE ' ' B' ' 46' ' ' ARG . 1.7 tpm_? -150.59 155.91 40.34 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.376 -175.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.1 136.55 79.29 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.72 -177.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 -30.57 91.09 Favored 'Trans proline' 0 N--CA 1.466 -0.126 0 C-N-CA 122.742 2.294 . . . . 0.0 112.513 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -73.24 -42.88 62.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.949 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -33.2 75.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.181 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.737 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 tp -62.11 -33.87 75.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.629 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -70.2 -40.28 74.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.77 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.67 -41.49 13.34 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 3.1 mtp -97.65 -34.14 11.05 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.655 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 113.07 177.95 19.55 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.205 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' LYS . . . . . 0.737 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -147.24 160.72 38.81 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 57' ' ' PRO . . . . . 0.468 ' HD2' ' HB2' ' B' ' 56' ' ' LYS . 11.9 Cg_endo -60.53 130.52 33.93 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.019 1.813 . . . . 0.0 112.887 -178.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' ASP . . . . . 0.419 ' HB2' ' C ' ' B' ' 127' ' ' SER . 48.0 t0 -92.34 97.69 11.03 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 173.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.647 HG23 ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -139.83 159.41 27.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.29 -175.879 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -28.29 36.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.255 -176.005 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.511 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 13.4 p-10 -130.02 69.98 1.44 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.342 0.591 . . . . 0.0 111.633 -174.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 62' ' ' TYR . . . . . 0.754 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -136.45 142.53 43.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.274 176.696 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.722 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 34.2 mttm -127.69 121.9 31.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 -177.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -76.93 129.23 35.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.529 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 65' ' ' MET . . . . . 0.871 ' HB3' ' HB2' ' B' ' 70' ' ' LEU . 14.6 mmt . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.721 174.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.871 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.467 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.606 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.89 -57.08 11.03 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.09 -175.953 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.486 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 9.6 Cg_exo -71.63 -17.67 29.57 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.21 1.94 . . . . 0.0 112.35 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.527 ' HA ' HD22 ' B' ' 73' ' ' LEU . 0.2 OUTLIER -80.51 -22.81 40.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.878 0.37 . . . . 0.0 110.131 177.348 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.916 HD21 HD21 ' B' ' 102' ' ' LEU . 4.6 tp -57.19 -52.02 66.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.31 177.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.654 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.441 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 76' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -71.46 -25.75 62.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.904 0.383 . . . . 0.0 111.019 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 77' ' ' SER . . . . . 0.722 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 47.7 m -78.19 -41.6 34.1 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.224 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.16 60.26 1.33 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.65 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.423 HD11 HD11 ' B' ' 43' ' ' ILE . 7.6 mt -94.72 151.15 19.51 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.0 OUTLIER -122.26 130.52 24.66 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 81' ' ' PRO . . . . . 0.437 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 59.5 Cg_exo -60.63 -6.95 6.39 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.697 2.931 . . . . 0.0 114.935 -171.643 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -90.6 -7.51 52.57 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.827 -0.545 . . . . 0.0 110.389 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 4.3 mttp -82.02 126.09 75.75 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.607 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.555 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 5.9 Cg_exo -72.24 122.16 8.13 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.192 1.928 . . . . 0.0 109.969 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 13.0 m -127.62 153.21 36.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.101 0.477 . . . . 0.0 111.565 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.406 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 1.4 p -124.28 143.05 39.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 176.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 m -106.43 122.94 60.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.8 0.333 . . . . 0.0 110.513 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' PHE . . . . . 0.886 ' HB2' HD11 ' B' ' 42' ' ' LEU . 0.3 OUTLIER -91.69 123.58 35.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.852 -178.845 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -168.621 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.211 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 96' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' B' ' 100' ' ' LYS . . . -59.57 -34.29 72.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.172 177.246 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -72.94 -35.23 66.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.811 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 98' ' ' ALA . . . . . 0.559 ' HA ' ' HZ ' ' A' ' 11' ' ' PHE . . . -71.4 -44.18 65.42 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.034 0.445 . . . . 0.0 110.561 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 99' ' ' GLY . . . . . 0.428 ' HA3' ' HE1' ' B' ' 22' ' ' MET . . . -76.02 -51.47 6.91 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.424 -177.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 100' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' B' ' 104' ' ' GLU . 0.0 OUTLIER -62.8 -31.77 72.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.907 0.353 . . . . 0.0 111.268 -174.791 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 101' ' ' THR . . . . . 0.5 HG22 ' CE2' ' B' ' 105' ' ' TYR . 10.8 m -73.03 -35.78 66.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.735 0.302 . . . . 0.0 110.98 175.089 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 102' ' ' LEU . . . . . 0.916 HD21 HD21 ' B' ' 74' ' ' LEU . 6.8 mt -62.65 -49.98 73.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.144 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 103' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -64.44 -27.01 68.7 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.874 0.368 . . . . 0.0 110.409 178.208 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' B' ' 100' ' ' LYS . 4.7 tt0 -71.14 -8.42 53.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.029 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 105' ' ' TYR . . . . . 0.518 ' CZ ' ' HB ' ' A' ' 10' ' ' THR . 21.4 m-30 -112.01 -8.09 14.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.778 0.323 . . . . 0.0 111.117 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.66 49.7 0.34 Allowed Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.127 -1.035 . . . . 0.0 112.98 174.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 107' ' ' PHE . . . . . 0.572 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.0 m-85 -99.43 149.26 23.38 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.125 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 108' ' ' LYS . . . . . 0.447 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -63.01 -91.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.42 -175.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.447 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.9 OUTLIER -116.36 122.25 44.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.34 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 110' ' ' ILE . . . . . 0.567 HG12 ' HE3' ' B' ' 22' ' ' MET . 1.2 tt -120.22 129.13 75.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.275 0.559 . . . . 0.0 111.285 -175.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 111' ' ' TYR . . . . . 0.406 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 1.2 m-85 -116.59 148.68 40.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.067 -177.051 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.729 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 10.3 t-20 -115.52 143.09 45.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.445 ' HB3' ' HA ' ' B' ' 88' ' ' PHE . 13.7 p -80.97 133.97 35.61 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.425 0.631 . . . . 0.0 111.511 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -86.18 123.34 31.35 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.507 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 115' ' ' GLY . . . . . 0.726 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 97.2 -79.29 0.67 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.673 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 116' ' ' GLY . . . . . 0.423 ' O ' ' HB2' ' B' ' 119' ' ' LYS . . . 150.27 -175.89 29.13 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.915 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 117' ' ' MET . . . . . 0.733 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -61.87 -27.47 68.81 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.933 0.493 . . . . 0.0 111.697 -176.61 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.425 ' O ' ' HG3' ' B' ' 122' ' ' GLU . 7.5 p-10 -67.85 -24.29 65.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 119' ' ' LYS . . . . . 0.726 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -72.18 -32.86 67.2 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.783 178.273 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 120' ' ' TRP . . . . . 0.773 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 23.7 t-105 -55.57 -48.77 74.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.956 0.407 . . . . 0.0 109.973 176.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 121' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' B' ' 121' ' ' LEU . 0.8 OUTLIER -65.52 -37.76 87.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.756 176.297 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.445 ' HB2' ' HA ' ' B' ' 119' ' ' LYS . 21.0 mt-10 -67.9 -41.26 82.98 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -176.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 123' ' ' GLU . . . . . 0.68 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 3.9 mm-40 -74.02 -7.84 53.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.342 . . . . 0.0 110.992 -178.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.28 25.95 58.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.29 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.572 ' HG ' ' HB2' ' B' ' 123' ' ' GLU . 58.9 mt -80.44 159.97 68.57 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.56 0.219 . . . . 0.0 110.516 -178.112 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.525 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 18.5 Cg_endo -56.81 116.89 3.52 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.057 2.505 . . . . 0.0 112.121 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 127' ' ' SER . . . . . 0.419 ' C ' ' HB2' ' B' ' 58' ' ' ASP . 0.0 OUTLIER -126.86 149.18 49.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.461 -177.872 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.32 -0.685 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.252 0 CA-C-O 120.753 0.311 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.763 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -55.7 -29.9 55.3 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.95 -177.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -39.81 79.58 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.799 0.333 . . . . 0.0 110.665 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -66.98 -58.45 4.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.562 -174.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.763 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 3.4 p90 -68.09 -25.32 65.27 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.975 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.25 -50.78 64.11 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.47 -45.34 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.787 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -47.53 77.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.796 0.331 . . . . 0.0 110.993 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.47 ' CD1' ' HB3' ' B' ' 71' ' ' GLU . 0.7 OUTLIER -57.12 -42.86 81.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.282 0.563 . . . . 0.0 109.787 179.027 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.24 -29.27 70.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.596 177.101 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.9 54.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.523 -178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -72.41 -49.38 34.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.027 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 t -60.51 -41.16 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -65.87 -27.6 68.34 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.65 -26.08 68.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.062 0.458 . . . . 0.0 111.099 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.15 -31.58 72.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.423 -178.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.502 ' HD2' ' SD ' ' A' ' 24' ' ' MET . 2.4 pttt -75.03 -20.18 59.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.908 0.385 . . . . 0.0 111.614 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -23.55 57.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.418 -177.103 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -85.61 4.56 35.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -175.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -145.56 162.77 36.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.65 0.262 . . . . 0.0 110.829 178.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 20.8 t -77.29 113.01 15.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.811 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.502 ' SD ' ' HD2' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.26 112.99 17.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.487 179.733 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.62 145.28 49.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.086 0.469 . . . . 0.0 110.52 -178.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.36 141.45 36.92 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.168 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.11 -22.72 5.54 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 124.07 3.18 . . . . 0.0 114.997 -174.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.509 ' HA ' ' HD2' ' A' ' 28' ' ' LYS . 2.1 mmmm -73.65 -44.14 57.63 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.825 -0.547 . . . . 0.0 110.891 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.555 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 10.5 t0 -72.7 -37.29 67.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.853 176.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.48 -46.72 84.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.15 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.43 ' CE1' HG12 ' A' ' 59' ' ' VAL . 80.4 t80 -63.63 -42.8 98.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.804 -177.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -66.45 -41.54 88.97 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.813 -173.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 29' ' ' ASP . 0.3 OUTLIER -72.35 -27.38 62.38 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.598 176.082 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.611 HD11 ' HB2' ' A' ' 42' ' ' LEU . 1.9 mt -59.1 -50.56 73.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.767 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -76.26 -34.67 59.16 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.159 -177.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -70.47 -22.73 62.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.613 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -115.81 140.28 25.95 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-O 121.06 0.457 . . . . 0.0 111.659 -177.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.82 -9.4 10.93 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.778 2.318 . . . . 0.0 111.579 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.503 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -92.34 -67.02 0.88 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.299 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.753 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 52.3 mt -41.97 102.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.439 -175.002 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.797 HG21 ' HE2' ' A' ' 63' ' ' LYS . 26.4 m -101.85 145.09 29.68 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.271 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.991 HD11 ' HB2' ' A' ' 88' ' ' PHE . 18.1 tp -104.16 127.18 51.74 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.799 HD11 HD11 ' A' ' 79' ' ' LEU . 4.5 mt -106.69 114.57 46.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.087 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.784 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -100.41 135.78 41.31 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.627 -177.671 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -114.68 96.77 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 121.994 0.902 . . . . 0.0 109.809 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.682 ' HA ' ' NE ' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -143.4 142.52 31.27 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.611 177.468 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -71.94 140.34 83.36 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -174.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -52.76 -27.41 34.02 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 123.585 2.857 . . . . 0.0 114.362 -168.671 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.684 ' HB3' ' HB3' ' B' ' 49' ' ' ASP . 0.7 OUTLIER -79.92 -31.62 40.11 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.903 178.403 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -36.92 72.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.982 0.42 . . . . 0.0 110.105 176.399 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.56 HD13 ' HB3' ' A' ' 46' ' ' ARG . 1.6 tp -60.65 -33.9 73.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.416 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.2 mttt -70.79 -38.59 73.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.261 177.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.83 -48.02 19.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.548 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 21.8 mmm -102.64 -34.02 9.23 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.556 -173.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 121.61 179.63 16.06 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.299 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.477 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -132.81 150.98 77.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.422 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 37.9 Cg_exo -62.34 134.91 50.93 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.514 2.143 . . . . 0.0 113.021 -176.316 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.475 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 26.9 t70 -101.26 92.35 4.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.699 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 62' ' ' TYR . 5.3 m -133.63 159.31 42.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.068 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -57.35 -41.42 80.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.303 -177.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.536 ' HB2' ' HA ' ' A' ' 41' ' ' THR . 0.1 OUTLIER -121.4 82.33 1.92 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.745 -177.305 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.784 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 3.2 t80 -120.31 125.94 49.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.797 ' HE2' HG21 ' A' ' 41' ' ' THR . 11.3 mttm -122.13 120.62 34.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.016 0.436 . . . . 0.0 110.123 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.425 ' HD2' ' O ' ' A' ' 44' ' ' ASP . 12.9 t-160 -88.24 128.32 35.46 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.233 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.65 0 CA-C-O 121.075 0.465 . . . . 0.0 109.761 175.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.603 HD21 ' CZ ' ' B' ' 11' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.256 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.863 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.1 mt-10 -47.35 -62.08 2.36 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.162 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.863 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 3.4 Cg_exo -75.12 -17.36 19.36 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.493 2.129 . . . . 0.0 113.711 178.063 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.0 -27.51 19.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -173.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.514 HD12 HD12 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -69.52 -28.84 66.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.23 0.538 . . . . 0.0 110.384 -177.557 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.433 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -76.91 -33.26 57.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.224 173.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . 0.651 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 11.4 mttt -62.69 -29.77 70.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.86 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -41.07 24.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.695 0.283 . . . . 0.0 110.874 -177.703 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.49 52.07 2.07 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.582 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.799 HD11 HD11 ' A' ' 43' ' ' ILE . 3.5 mt -75.81 143.58 41.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.407 0.146 . . . . 0.0 110.636 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.484 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -114.19 136.06 22.21 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.665 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 80' ' ' ASP . 25.6 Cg_exo -69.57 1.01 4.68 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.842 2.361 . . . . 0.0 114.06 -172.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.651 ' HA ' ' HD2' ' A' ' 108' ' ' LYS . 3.9 mt-10 -99.89 -7.1 25.7 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 121.996 -0.44 . . . . 0.0 110.715 178.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -84.19 118.65 71.77 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.277 177.485 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.753 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 8.4 Cg_exo -67.79 108.86 1.76 Allowed 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.45 2.1 . . . . 0.0 110.16 174.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.554 HG12 ' HB ' ' A' ' 41' ' ' THR . 9.0 m -114.64 154.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.292 0.568 . . . . 0.0 111.576 -172.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.536 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 1.5 p -123.85 142.56 40.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.264 177.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.856 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 6.0 m -108.46 126.09 65.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.991 ' HB2' HD11 ' A' ' 42' ' ' LEU . 3.7 t80 -100.83 126.21 47.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.947 -0.569 . . . . 0.0 112.062 -171.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' CYS . . . . . 0.776 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.964 0 O-C-N 124.957 1.411 . . . . 0.0 110.934 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.856 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.463 0.197 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.95 -29.57 60.36 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.16 -34.49 71.01 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.829 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.89 61.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.915 0.388 . . . . 0.0 110.749 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.42 -53.23 3.91 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.945 -175.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.435 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -61.49 -33.39 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 122.545 -0.385 . . . . 0.0 111.763 -172.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.435 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 3.5 m -71.55 -36.39 70.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 110.921 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 102' ' ' LEU . 15.0 mt -69.92 -44.2 70.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.568 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.534 ' HA ' ' HB2' ' A' ' 107' ' ' PHE . 0.0 OUTLIER -63.91 -31.51 72.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.75 0.309 . . . . 0.0 110.735 -179.037 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.09 -5.22 50.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.262 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -103.41 -10.51 18.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.052 177.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.21 1.27 3.24 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 119.753 -1.213 . . . . 0.0 113.93 174.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.534 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 8.0 m-85 -67.69 136.82 54.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.212 0.506 . . . . 0.0 110.403 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.651 ' HD2' ' HA ' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -67.12 -81.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.715 -174.327 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.412 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -112.19 113.59 25.92 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.825 -177.106 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 0.7 OUTLIER -117.23 127.7 74.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.212 0.529 . . . . 0.0 110.479 -179.67 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.536 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 13.6 m-85 -112.69 145.0 41.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.996 -176.062 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -112.0 136.68 51.03 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.533 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 16.4 m -91.73 117.63 29.93 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -55.94 121.6 9.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.733 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 86.84 -108.34 3.32 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.983 -177.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLY . . . . . 0.484 ' CA ' ' HA ' ' A' ' 89' ' ' CYS . . . 159.06 -154.83 25.9 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.034 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' MET . . . . . 0.438 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 16.7 ttp -50.67 -33.65 23.44 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.844 0.457 . . . . 0.0 111.748 -177.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.53 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 27.0 t70 -58.43 -40.37 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.084 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -73.96 -31.94 63.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.632 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.726 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 22.5 t-105 -59.51 -53.86 53.27 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.23 -38.91 91.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.95 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -66.21 -44.8 82.84 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.707 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -81.78 20.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -175.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 65.66 24.8 71.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.251 -0.5 . . . . 0.0 113.153 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 120' ' ' TRP . 17.6 mt -83.44 152.05 63.37 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.852 0.358 . . . . 0.0 110.702 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.475 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 33.8 Cg_endo -66.01 118.71 5.73 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.79 2.326 . . . . 0.0 112.835 -176.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.76 149.84 42.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.434 175.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.403 ' CB ' ' HD2' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -102.61 124.9 48.99 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.514 -177.631 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--N 1.323 -0.583 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.558 179.489 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.276 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 4' ' ' GLY . . . . . 0.612 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.14 -35.21 63.93 Favored Glycine 0 C--O 1.224 -0.476 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.921 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -33.61 58.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.841 0.353 . . . . 0.0 111.258 178.232 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -68.19 -56.46 8.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.612 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.9 OUTLIER -74.46 -22.27 59.18 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.583 -177.498 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 1.1 t70 -53.11 -50.1 65.15 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.819 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.21 -38.56 77.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.428 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -46.4 64.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 0.0 110.619 178.878 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 11' ' ' PHE . . . . . 0.603 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -56.01 -48.85 75.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.451 -179.158 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 12' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -62.47 -26.13 68.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.534 179.08 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.7 -44.4 56.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.068 0.461 . . . . 0.0 111.409 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.3 -49.83 31.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.902 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.9 t -64.09 -34.27 67.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.319 -175.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.621 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -64.02 -27.89 69.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.552 0.215 . . . . 0.0 111.345 178.747 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -25.57 68.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.94 0.4 . . . . 0.0 110.887 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.65 -32.5 64.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.882 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -78.15 -23.08 47.86 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.481 0.658 . . . . 0.0 110.366 171.939 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.58 -18.88 58.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.803 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -79.89 -2.29 42.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.282 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' MET . . . . . 0.548 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 1.0 OUTLIER -139.63 172.72 12.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 111.076 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 17.6 t -82.09 112.44 19.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.729 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' MET . . . . . 0.634 ' SD ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -72.7 100.47 2.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.764 -0.198 . . . . 0.0 110.524 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 25' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' B' ' 113' ' ' SER . 1.2 mt -117.68 134.2 55.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.146 0.498 . . . . 0.0 110.449 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.38 152.33 70.25 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.567 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 6.9 Cg_endo -51.72 -20.93 10.3 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 123.661 2.907 . . . . 0.0 114.701 -174.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.497 ' HA ' ' HD2' ' B' ' 28' ' ' LYS . 5.8 mmmm -75.44 -48.01 24.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.102 0.477 . . . . 0.0 110.975 176.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.81 -31.37 64.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.689 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.14 -43.92 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.63 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' TYR . . . . . 0.437 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 89.3 t80 -68.55 -31.7 71.11 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.065 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -53.7 55.15 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.054 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.513 HD13 HD13 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -74.46 -27.33 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.134 179.779 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.711 HD11 ' HB2' ' B' ' 42' ' ' LEU . 5.7 mt -57.74 -55.0 40.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.06 -177.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 35' ' ' GLN . . . . . 0.886 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 15.6 mm100 -74.59 -19.03 60.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.907 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -35.08 15.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.754 0.312 . . . . 0.0 111.478 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 1.2 m-80 -92.43 127.33 49.09 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -76.76 -9.55 18.33 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.632 2.221 . . . . 0.0 111.285 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' ASP . . . . . 0.422 ' CG ' ' HG3' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -90.99 -69.45 0.73 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 177.168 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.759 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 53.6 mt -44.11 109.75 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.833 -175.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.609 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -106.49 145.75 31.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.003 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.711 ' HB2' HD11 ' B' ' 34' ' ' LEU . 13.9 tp -102.44 124.41 47.97 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 96.4 mt -103.84 113.11 39.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.817 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.91 137.43 39.3 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.221 -177.434 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -115.34 97.19 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 121.87 0.843 . . . . 0.0 110.04 175.159 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 46' ' ' ARG . . . . . 0.59 ' HA ' ' NE ' ' B' ' 46' ' ' ARG . 0.8 OUTLIER -148.41 134.29 19.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.423 177.715 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.83 147.63 96.2 Favored Pre-proline 0 C--N 1.318 -0.78 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.056 -171.22 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -49.9 -32.74 31.14 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 124.055 3.17 . . . . 0.0 113.869 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.684 ' HB3' ' HB3' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -71.25 -43.05 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.724 0.297 . . . . 0.0 110.896 -179.407 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 50' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 8.0 mt-10 -67.27 -36.97 82.67 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.7 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.408 ' CD1' ' HB3' ' B' ' 46' ' ' ARG . 0.5 OUTLIER -61.8 -34.58 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.796 177.319 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -72.79 -41.43 64.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.928 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.02 -48.47 16.09 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -173.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -99.48 -35.63 9.82 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.628 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.62 -175.93 16.11 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.616 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.61 160.27 64.11 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' PRO . . . . . 0.436 ' HB3' ' CZ2' ' B' ' 120' ' ' TRP . 25.5 Cg_exo -63.0 124.86 14.72 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.223 1.949 . . . . 0.0 112.913 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' ASP . . . . . 0.827 ' HB3' ' HB2' ' B' ' 126' ' ' PRO . 25.6 t70 -90.35 88.06 7.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.013 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.6 m -134.98 167.51 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' LYS . . . . . 0.886 ' HD2' ' HA ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -76.04 -27.84 57.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.929 0.395 . . . . 0.0 111.17 -176.88 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -122.65 68.77 0.97 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.458 -175.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' TYR . . . . . 0.817 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.3 t80 -121.79 127.49 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.816 0.341 . . . . 0.0 110.345 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.723 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 61.8 mttm -122.83 122.33 38.41 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 177.372 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -88.87 133.18 34.37 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 -177.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' MET . . . . . 0.536 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.474 0 CA-C-O 121.085 0.469 . . . . 0.0 110.796 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.735 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.735 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -54.38 -46.56 98.99 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -174.659 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.535 ' HD3' ' OE1' ' B' ' 71' ' ' GLU . 58.3 Cg_endo -71.18 -20.14 28.72 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.333 1.355 . . . . 0.0 111.921 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.536 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -86.33 -26.47 24.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.189 0.518 . . . . 0.0 110.015 177.404 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.943 HD21 HD21 ' B' ' 102' ' ' LEU . 4.6 tp -58.0 -52.75 64.21 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.958 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.69 -28.49 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.636 -175.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 76' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -91.75 -13.48 31.51 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.361 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 77' ' ' SER . . . . . 0.723 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 20.3 m -72.86 -27.67 62.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.897 0.38 . . . . 0.0 110.5 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' GLY . . . . . 0.42 ' O ' ' HE3' ' B' ' 63' ' ' LYS . . . 90.77 64.02 1.21 Allowed Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.433 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.2 mt -113.31 140.69 47.79 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.649 0.262 . . . . 0.0 110.406 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.87 ' HB3' ' HE3' ' B' ' 83' ' ' LYS . 3.3 t70 -114.55 133.03 22.58 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 81' ' ' PRO . . . . . 0.611 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 10.0 Cg_endo -57.6 -10.03 6.37 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.599 2.866 . . . . 0.0 115.266 -171.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.412 ' H ' ' HG3' ' B' ' 82' ' ' GLU . 0.0 OUTLIER -93.54 -10.53 34.52 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.679 -0.638 . . . . 0.0 110.924 179.825 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 83' ' ' LYS . . . . . 0.87 ' HE3' ' HB3' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -78.7 121.2 83.26 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.534 -177.407 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.759 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 4.8 Cg_exo -72.87 117.47 5.14 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.436 2.091 . . . . 0.0 109.984 173.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 12.3 m -121.1 158.24 23.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-O 121.313 0.578 . . . . 0.0 111.457 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.97 140.6 44.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 87' ' ' VAL . . . . . 0.955 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 1.8 m -110.84 122.48 65.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.122 0.487 . . . . 0.0 110.13 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 88' ' ' PHE . . . . . 0.772 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -81.34 161.39 23.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.376 -175.993 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 171.751 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 95' ' ' ALA . . . . . 0.955 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.53 0.173 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.03 -29.36 63.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.787 -176.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 97' ' ' LEU . . . . . 0.467 ' HA ' HD13 ' B' ' 97' ' ' LEU . 2.4 mm? -76.98 -31.33 56.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.819 0.343 . . . . 0.0 110.879 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.88 -35.1 62.31 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.025 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -94.7 -54.92 1.47 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.443 -0.884 . . . . 0.0 114.273 -174.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -28.44 67.87 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 122.399 -0.471 . . . . 0.0 111.981 -171.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.53 -35.83 70.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.892 0.377 . . . . 0.0 111.109 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 102' ' ' LEU . . . . . 0.943 HD21 HD21 ' B' ' 74' ' ' LEU . 15.4 mt -63.81 -46.61 84.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.751 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 103' ' ' ARG . . . . . 0.554 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.0 OUTLIER -66.02 -26.86 67.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.833 0.349 . . . . 0.0 110.725 -179.215 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.02 -6.16 36.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.219 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -110.56 -9.2 14.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.221 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 130.28 5.18 4.28 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.918 -1.134 . . . . 0.0 113.58 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 107' ' ' PHE . . . . . 0.611 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 5.9 m-85 -66.05 135.35 54.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.177 0.489 . . . . 0.0 110.276 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 6.3 mttt -61.24 -84.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.563 -174.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.35 119.13 35.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.095 0.474 . . . . 0.0 110.837 -178.08 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 110' ' ' ILE . . . . . 0.486 HG21 ' HG2' ' B' ' 103' ' ' ARG . 0.4 OUTLIER -117.34 128.38 74.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-O 121.177 0.513 . . . . 0.0 110.588 -178.192 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -115.41 146.56 41.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.121 -175.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.634 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 4.5 t-20 -114.47 141.9 47.09 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.508 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 14.6 m -86.9 105.58 17.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.25 0.548 . . . . 0.0 111.611 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 21.75 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.929 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -116.44 -66.44 0.38 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.182 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 123.53 170.48 13.4 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.444 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 117' ' ' MET . . . . . 0.526 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 1.0 OUTLIER -63.16 -34.71 78.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.021 0.439 . . . . 0.0 110.484 -179.549 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -62.1 -31.13 71.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.053 178.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 119' ' ' LYS . . . . . 0.567 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -72.81 -32.12 65.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.963 179.392 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 120' ' ' TRP . . . . . 0.772 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.7 t-105 -60.21 -53.86 52.7 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 177.581 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 121' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' B' ' 121' ' ' LEU . 6.5 mt -63.93 -40.92 97.58 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -63.57 -43.85 95.82 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.885 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 123' ' ' GLU . . . . . 0.407 ' HB3' ' HD3' ' B' ' 28' ' ' LYS . 12.8 mm-40 -72.0 1.38 7.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.672 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.12 27.47 66.25 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.932 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 85.5 mt -82.66 150.99 64.0 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.827 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 13.5 Cg_endo -57.68 128.39 29.02 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 123.084 2.522 . . . . 0.0 112.547 -176.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.81 142.97 46.23 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.294 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.636 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.1 mpp? . . . . . 0 N--CA 1.461 0.084 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.738 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -53.52 -32.76 46.41 Favored Glycine 0 C--O 1.226 -0.402 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.876 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.88 -32.55 74.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.994 0.425 . . . . 0.0 111.418 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.4 mmtm -69.79 -57.73 4.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.924 -175.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.738 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 4.9 p90 -77.79 -28.38 50.46 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.311 -0.556 . . . . 0.0 112.165 -174.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -45.0 71.11 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.006 0.431 . . . . 0.0 110.563 -177.732 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.63 -41.85 95.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.226 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -44.5 75.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.015 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -53.98 -46.84 71.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.264 0.554 . . . . 0.0 110.358 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.95 -26.53 65.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.466 178.235 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.86 -41.45 74.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.981 0.419 . . . . 0.0 110.602 177.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -71.32 -49.78 39.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.445 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.552 HG11 ' HG2' ' B' ' 71' ' ' GLU . 1.1 t -65.63 -35.77 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.951 -174.054 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.2 mttt -63.57 -30.2 71.35 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.803 0.335 . . . . 0.0 111.184 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.82 -26.37 68.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.145 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.55 -32.94 64.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.97 -178.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -78.42 -23.43 46.69 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.382 0.611 . . . . 0.0 110.582 172.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.01 -18.17 38.01 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.38 -22.26 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.889 -175.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.618 ' HE3' HG12 ' A' ' 110' ' ' ILE . 4.3 ptm -127.43 179.55 5.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.668 0.271 . . . . 0.0 111.018 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.5 t -80.14 108.24 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.471 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.13 121.6 25.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.944 0.402 . . . . 0.0 110.644 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 113' ' ' SER . 3.6 mt -134.73 143.61 47.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.065 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.98 141.88 75.48 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.888 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.652 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 5.8 Cg_endo -49.83 -22.92 7.84 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.825 3.017 . . . . 0.0 114.331 -175.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -45.83 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.076 -0.39 . . . . 0.0 110.642 174.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -68.32 -29.49 68.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.195 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.61 -46.06 49.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.779 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.608 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 66.5 t80 -66.26 -28.53 68.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 0.0 110.768 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -53.58 56.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.517 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -73.43 -27.39 61.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.711 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.625 HD11 ' HB2' ' A' ' 42' ' ' LEU . 1.1 mt -60.71 -55.25 35.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -74.0 -26.75 60.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.028 -176.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -79.08 -40.11 32.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.934 0.397 . . . . 0.0 110.584 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -118.78 100.51 50.97 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.669 -176.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -68.13 5.08 1.25 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.977 2.451 . . . . 0.0 112.394 178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.73 -33.12 23.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.552 174.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.689 HG12 ' HB2' ' A' ' 84' ' ' PRO . 13.9 mt -86.63 106.93 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.389 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.501 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -95.65 146.41 24.51 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.686 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.625 ' HB2' HD11 ' A' ' 34' ' ' LEU . 7.9 tp -98.45 127.62 44.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 83.1 mt -111.86 121.85 65.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.424 ' OD2' ' CE1' ' A' ' 64' ' ' HIS . 17.3 t70 -109.3 148.14 31.52 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.226 -179.022 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.39 98.82 5.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.542 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.413 ' HA ' ' HD2' ' A' ' 46' ' ' ARG . 8.5 mmm-85 -156.28 -170.81 3.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.669 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.43 ' HB3' ' HG3' ' A' ' 50' ' ' GLU . 3.9 t70 -100.02 129.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.843 0.354 . . . . 0.0 110.268 176.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.05 -19.34 65.91 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.684 2.256 . . . . 0.0 113.086 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -72.01 -51.26 22.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.779 0.324 . . . . 0.0 111.061 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HB3' ' CB ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -73.16 -27.6 61.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.338 177.137 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.98 -46.69 87.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.111 174.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -30.89 71.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.72 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.29 -48.3 11.38 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 36.6 mtm -92.24 -34.45 14.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -171.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 139.19 146.12 4.87 Favored Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.541 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.44 141.52 40.7 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 177.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.425 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 9.4 Cg_endo -56.98 121.9 10.88 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.547 2.165 . . . . 0.0 112.438 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -93.22 93.38 8.21 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.686 HG22 ' HB2' ' A' ' 62' ' ' TYR . 15.9 m -132.07 162.48 39.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.31 83.44 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.501 ' HB2' HG23 ' A' ' 41' ' ' THR . 19.4 p-10 -128.75 79.9 1.94 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.571 0.7 . . . . 0.0 111.286 -174.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.686 ' HB2' HG22 ' A' ' 59' ' ' VAL . 9.3 t80 -122.3 129.86 52.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.279 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.467 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 0.0 OUTLIER -125.07 122.39 37.06 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.183 0.516 . . . . 0.0 110.934 178.911 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.424 ' CE1' ' OD2' ' A' ' 44' ' ' ASP . 1.2 t60 -92.0 116.95 29.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.426 177.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.918 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.611 0 CA-C-O 120.655 0.264 . . . . 0.0 110.791 -176.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.918 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.674 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.605 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -44.67 -58.5 5.22 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -173.443 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.605 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 13.3 Cg_exo -73.16 -16.95 25.01 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 122.079 1.853 . . . . 0.0 113.209 -175.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.741 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -96.46 -15.33 21.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.651 0.262 . . . . 0.0 110.685 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.736 HD13 HD11 ' A' ' 70' ' ' LEU . 30.6 tp -58.16 -54.95 41.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.168 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.76 -16.41 61.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.838 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -88.58 -17.9 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.467 ' HB2' ' HD2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -100.84 43.85 1.04 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.766 -175.664 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 43.47 64.7 1.73 Allowed Glycine 0 C--N 1.335 0.477 0 O-C-N 123.616 0.573 . . . . 0.0 113.459 175.667 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 74' ' ' LEU . 8.0 mt -116.32 128.64 55.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.131 0.491 . . . . 0.0 111.033 -177.591 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -129.82 149.93 74.44 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.809 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.36 17.75 0.28 Allowed 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.889 2.393 . . . . 0.0 113.59 -174.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.21 6.17 10.75 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.083 0.468 . . . . 0.0 110.179 176.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.1 mttm -106.88 133.8 20.12 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.689 ' HB2' HG12 ' A' ' 40' ' ' ILE . 2.5 Cg_endo -77.74 141.54 19.51 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.732 2.288 . . . . 0.0 110.721 175.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.521 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -143.93 148.32 18.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.834 0.349 . . . . 0.0 110.624 -177.595 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 p -123.86 140.05 48.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.981 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 13.3 m -108.57 134.72 49.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.345 -176.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.834 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.4 t80 -101.06 162.68 12.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.225 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' CYS . . . . . 0.548 ' HA ' ' HA2' ' A' ' 116' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 174.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.981 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.46 0.051 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.84 -31.91 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.697 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.64 -33.69 76.21 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.616 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.18 -49.73 18.54 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.039 0.447 . . . . 0.0 110.913 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLY . . . . . 0.422 ' HA3' ' CE ' ' A' ' 22' ' ' MET . . . -75.79 -51.69 6.93 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.46 -0.791 . . . . 0.0 114.127 -173.248 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -65.33 -30.57 71.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.914 0.387 . . . . 0.0 111.056 -174.282 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.482 HG22 ' CE2' ' A' ' 105' ' ' TYR . 32.7 m -72.16 -36.75 69.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.912 176.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.53 HD21 HD21 ' A' ' 74' ' ' LEU . 8.1 mt -68.05 -42.91 79.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.517 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 4.0 ptm180 -67.7 -27.24 66.66 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.849 0.357 . . . . 0.0 110.361 179.126 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.427 ' CD ' ' HZ1' ' A' ' 100' ' ' LYS . 0.5 OUTLIER -69.75 -6.91 35.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.361 174.644 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.522 ' CE1' ' HB ' ' B' ' 10' ' ' THR . 22.5 m-85 -107.4 -12.11 15.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.683 0.278 . . . . 0.0 110.762 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.46 50.98 0.73 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.323 173.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.459 ' CE1' HD22 ' A' ' 102' ' ' LEU . 2.0 m-85 -88.43 -179.84 6.17 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.679 -0.307 . . . . 0.0 110.584 177.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -85.46 -97.02 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.655 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.19 115.91 29.59 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.742 0.305 . . . . 0.0 110.554 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.618 HG12 ' HE3' ' A' ' 22' ' ' MET . 1.5 tt -118.05 127.72 75.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.068 0.461 . . . . 0.0 110.743 -176.202 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -115.62 144.95 43.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.625 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.582 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 4.1 t-20 -107.87 136.14 48.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 171.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.479 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.1 m -88.45 108.76 19.55 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.704 0.287 . . . . 0.0 111.759 -175.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -58.89 135.59 57.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.296 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 93.1 -106.88 3.47 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.75 -174.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLY . . . . . 0.584 ' H ' ' HB2' ' A' ' 119' ' ' LYS . . . 160.79 -156.97 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' MET . . . . . 0.472 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 2.2 ttm -59.02 -33.68 71.02 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.203 0.525 . . . . 0.0 109.987 177.294 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.496 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.8 OUTLIER -61.73 -32.28 72.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.014 177.205 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.652 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -74.6 -32.75 62.46 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 122.168 0.187 . . . . 0.0 111.476 178.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.834 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 24.8 t-105 -59.83 -53.32 59.35 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 121' ' ' LEU . 5.5 mt -64.84 -38.94 92.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.967 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.7 OUTLIER -65.51 -35.77 81.85 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.873 0.368 . . . . 0.0 111.483 -178.294 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.722 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.0 tp10 -79.43 -3.89 48.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.3 29.18 68.74 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 121.056 -0.593 . . . . 0.0 112.041 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.722 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 52.3 mt -80.94 160.65 65.69 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-O 120.679 0.276 . . . . 0.0 110.879 -176.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 21.0 Cg_endo -58.47 117.58 4.32 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.079 2.519 . . . . 0.0 112.47 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.4 m -128.44 146.39 50.82 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.2 mt -99.36 103.1 14.88 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.077 0.465 . . . . 0.0 110.105 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.676 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' MET . . . . . 0.552 ' HG3' ' HG3' ' B' ' 6' ' ' LYS . 1.9 mpp? . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.738 0.304 . . . . 0.0 111.279 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 4' ' ' GLY . . . . . 0.715 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.31 -39.24 81.9 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.633 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -63.48 -33.04 74.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.299 -0.451 . . . . 0.0 111.421 176.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.552 ' HG3' ' HG3' ' B' ' 3' ' ' MET . 1.7 mmmt -71.27 -52.24 20.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.626 -175.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.715 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 2.2 p90 -82.41 -24.31 34.44 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.267 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.92 -49.49 65.87 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.777 0.322 . . . . 0.0 110.683 -179.062 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.67 -44.71 77.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.255 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' THR . . . . . 0.522 ' HB ' ' CE1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -64.89 -42.86 94.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.938 179.132 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 11' ' ' PHE . . . . . 0.468 ' O ' ' HB ' ' B' ' 15' ' ' VAL . 0.5 OUTLIER -57.85 -47.96 81.17 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.013 0.435 . . . . 0.0 110.428 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 12' ' ' LYS . . . . . 0.607 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.41 -25.9 68.22 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.185 177.597 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.21 -47.53 27.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.101 0.477 . . . . 0.0 111.262 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.89 -50.37 35.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.688 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.468 ' HB ' ' O ' ' B' ' 11' ' ' PHE . 0.5 OUTLIER -60.2 -33.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.633 -176.791 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.607 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.1 OUTLIER -70.8 -38.9 73.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.594 0.235 . . . . 0.0 110.978 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.08 -25.82 64.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.493 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.34 81.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.683 -179.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' B' ' 16' ' ' LYS . 4.9 pttp -77.62 -22.0 51.44 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.293 0.568 . . . . 0.0 110.865 174.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.79 -19.48 52.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.54 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 25.4 t70 -69.18 -25.84 64.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.751 -175.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' MET . . . . . 0.434 ' CE ' ' HA3' ' B' ' 99' ' ' GLY . 12.4 ptm -117.49 179.87 3.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.814 0.34 . . . . 0.0 111.708 -177.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 34.8 t -76.61 113.64 15.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.527 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.04 112.67 21.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.896 -177.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' B' ' 25' ' ' LEU . 4.1 mt -112.39 -169.09 1.41 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.02 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.69 144.65 47.11 Favored Pre-proline 0 C--N 1.317 -0.848 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 173.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.0 -25.14 11.92 Favored 'Trans proline' 0 CA--C 1.531 0.335 0 C-N-CA 123.554 2.836 . . . . 0.0 113.581 -176.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -43.22 59.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.969 0.414 . . . . 0.0 110.72 176.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ASP . . . . . 0.464 ' HB3' HD13 ' B' ' 25' ' ' LEU . 0.2 OUTLIER -73.89 -32.97 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.95 178.462 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.617 ' HB1' HG21 ' B' ' 86' ' ' VAL . . . -66.69 -47.33 72.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.734 178.221 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' TYR . . . . . 0.618 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 71.5 t80 -67.92 -30.53 69.87 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.811 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -55.73 -53.1 60.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.946 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.2 OUTLIER -74.36 -27.05 60.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.813 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.7 HD11 ' HB2' ' B' ' 42' ' ' LEU . 2.9 mt -60.46 -55.9 27.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.024 0.44 . . . . 0.0 111.797 -178.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -76.03 -19.12 58.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.103 -0.499 . . . . 0.0 112.02 -173.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -16.72 18.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.486 -178.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.571 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 10.6 m-80 -121.32 101.24 44.22 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -66.2 -5.51 12.61 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 123.161 2.574 . . . . 0.0 113.416 -176.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' ASP . . . . . 0.422 ' CG ' ' HZ2' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -98.28 -19.67 17.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.745 0.307 . . . . 0.0 110.84 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.628 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 26.5 mt -82.68 105.24 12.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.926 176.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.672 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -98.72 145.18 27.17 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.05 -176.615 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.957 HD11 ' HB2' ' B' ' 88' ' ' PHE . 12.7 tp -100.91 125.18 47.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.149 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 2.0 mt -105.55 115.57 47.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.757 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -101.26 133.66 45.5 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -126.78 98.96 5.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.599 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -160.16 154.93 24.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.314 -174.252 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' B' ' 46' ' ' ARG . 0.0 OUTLIER -59.74 144.89 84.75 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 120.986 0.422 . . . . 0.0 111.241 -178.835 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.06 -18.54 35.55 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 123.322 2.681 . . . . 0.0 114.01 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.49 ' CB ' ' HB3' ' A' ' 50' ' ' GLU . 1.0 OUTLIER -74.89 -42.65 57.42 Favored 'General case' 0 CA--C 1.51 -0.568 0 O-C-N 121.867 -0.521 . . . . 0.0 111.296 -178.052 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -66.53 -35.09 79.39 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.799 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.4 mp -56.68 -34.17 67.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.417 176.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -79.31 -41.13 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.032 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.24 -48.06 13.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.476 -172.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -97.7 -34.32 10.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.755 0.312 . . . . 0.0 110.795 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 176.42 14.94 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.009 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' LYS . . . . . 0.799 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.1 OUTLIER -134.67 151.33 75.68 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.054 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -57.18 125.96 20.6 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.762 2.308 . . . . 0.0 112.671 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' ASP . . . . . 0.808 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 7.4 t0 -100.37 91.47 4.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.335 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.521 HG23 ' H ' ' B' ' 61' ' ' ASN . 2.8 m -128.49 166.39 25.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 176.298 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -29.14 67.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.824 0.345 . . . . 0.0 111.239 -176.177 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.588 ' HB2' HG23 ' B' ' 41' ' ' THR . 5.1 p30 -131.22 77.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.261 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 62' ' ' TYR . . . . . 0.757 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.6 OUTLIER -130.42 141.01 50.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.961 178.165 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.672 ' HE2' HG21 ' B' ' 41' ' ' THR . 0.0 OUTLIER -135.31 135.41 40.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.86 0.362 . . . . 0.0 110.675 175.65 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -88.69 118.64 28.51 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 65' ' ' MET . . . . . 0.467 ' HB3' ' HB2' ' B' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.676 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.535 HD12 HD13 ' B' ' 74' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.112 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.694 ' HB2' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -45.94 -66.1 0.56 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -174.46 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.694 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 55.3 Cg_endo -74.43 -15.13 22.42 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 121.99 1.794 . . . . 0.0 113.79 -177.128 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.477 HD22 ' HA ' ' B' ' 73' ' ' LEU . 0.1 OUTLIER -83.04 -15.11 52.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.218 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.964 HD21 HD21 ' B' ' 102' ' ' LEU . 9.0 tp -58.51 -53.84 53.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.975 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.09 -24.94 65.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.73 -25.98 49.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.745 -175.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -106.31 43.99 1.09 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -173.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.75 77.77 0.09 OUTLIER Glycine 0 C--N 1.336 0.566 0 N-CA-C 114.495 0.558 . . . . 0.0 114.495 172.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.426 HD21 ' HE3' ' B' ' 63' ' ' LYS . 53.3 mt -127.59 136.19 51.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.711 0.255 . . . . 0.0 110.697 177.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.475 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 3.5 t0 -135.47 136.63 24.43 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.624 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 81' ' ' PRO . . . . . 0.562 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 32.9 Cg_exo -63.35 11.82 0.09 OUTLIER 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 123.542 2.828 . . . . 0.0 114.828 -173.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.95 -8.53 17.57 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 121.778 -0.576 . . . . 0.0 110.492 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 83' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.8 mttp -90.93 134.18 30.75 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.751 -176.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.628 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 1.3 Cg_endo -78.6 121.82 5.28 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.756 2.304 . . . . 0.0 110.198 171.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.531 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.1 OUTLIER -127.23 151.68 34.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 120.959 0.409 . . . . 0.0 111.177 -174.876 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.617 HG21 ' HB1' ' B' ' 30' ' ' ALA . 1.4 p -125.18 140.19 48.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.013 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 87' ' ' VAL . . . . . 0.934 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 16.6 m -108.25 137.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.342 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 88' ' ' PHE . . . . . 0.957 ' HB2' HD11 ' B' ' 42' ' ' LEU . 8.3 t80 -120.19 143.9 47.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.575 -175.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 89' ' ' CYS . . . . . 0.403 ' SG ' ' HB2' ' B' ' 46' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.438 0 O-C-N 123.824 0.703 . . . . 0.0 111.31 -177.636 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 95' ' ' ALA . . . . . 0.934 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.529 0.165 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.05 -32.19 69.54 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.101 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -73.44 -26.94 61.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.858 0.361 . . . . 0.0 110.633 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.65 -44.63 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.007 0.432 . . . . 0.0 110.691 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 99' ' ' GLY . . . . . 0.434 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -85.32 -45.46 5.86 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.637 -0.792 . . . . 0.0 114.061 -173.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 100' ' ' LYS . . . . . 0.482 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -64.71 -34.77 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.99 0.424 . . . . 0.0 111.19 -174.906 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 101' ' ' THR . . . . . 0.482 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 3.9 m -72.56 -35.43 67.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.179 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 102' ' ' LEU . . . . . 0.964 HD21 HD21 ' B' ' 74' ' ' LEU . 8.1 mt -67.04 -42.98 83.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -177.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 103' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -65.45 -26.59 68.02 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.08 0.467 . . . . 0.0 110.211 178.5 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.02 -7.38 48.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.701 177.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 105' ' ' TYR . . . . . 0.428 ' CE2' HG22 ' B' ' 101' ' ' THR . 22.4 m-85 -108.21 -17.55 13.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.634 0.254 . . . . 0.0 110.876 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.73 29.05 1.46 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 119.987 -1.101 . . . . 0.0 113.351 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 107' ' ' PHE . . . . . 0.513 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.7 m-85 -74.36 154.97 38.62 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 108' ' ' LYS . . . . . 0.443 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -66.75 -92.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.065 0.459 . . . . 0.0 111.278 -174.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.443 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.2 OUTLIER -115.28 110.89 20.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.27 -178.935 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 110' ' ' ILE . . . . . 0.531 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.3 tt -112.23 128.58 68.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.035 0.445 . . . . 0.0 110.49 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -117.77 148.13 42.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.734 -174.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -116.77 141.58 48.02 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 16.1 m -91.1 107.44 19.2 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -175.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.48 158.13 34.45 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.021 0.438 . . . . 0.0 110.748 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 90.74 -78.71 1.43 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.76 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 142.27 -170.12 25.14 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.164 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 117' ' ' MET . . . . . 0.597 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 4.0 tpp -66.11 -30.28 70.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 110.32 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.28 -32.28 71.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.971 179.549 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 119' ' ' LYS . . . . . 0.407 ' HD2' ' OD1' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -69.64 -32.61 71.39 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 120' ' ' TRP . . . . . 0.788 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 18.2 t-105 -60.23 -54.86 40.71 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.256 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 7.1 mt -66.95 -39.39 87.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.127 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.568 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.9 OUTLIER -63.69 -43.41 96.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.799 -176.885 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 123' ' ' GLU . . . . . 0.474 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 3.1 tp10 -75.7 -2.95 31.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.25 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.35 30.4 60.6 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.799 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.474 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 52.2 mt -76.64 157.7 81.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.532 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 25.2 Cg_endo -61.52 120.54 8.24 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.849 2.366 . . . . 0.0 112.25 -177.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.22 144.54 38.52 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 128' ' ' LEU . . . . . 0.808 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 19.8 mt . . . . . 0 C--N 1.321 -0.665 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 120.858 0.361 . . . . 0.0 111.668 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.794 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -50.45 -24.97 7.94 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.513 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.7 -31.91 68.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.901 0.381 . . . . 0.0 111.218 177.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -64.98 -57.24 9.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.098 -175.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.794 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.2 p90 -76.28 -21.23 56.53 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.391 -176.266 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.602 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 0.7 OUTLIER -52.44 -49.81 63.85 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.348 0.405 . . . . 0.0 110.301 -178.328 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.81 85.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.458 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.5 -45.3 80.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.267 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.516 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.9 OUTLIER -58.97 -47.28 85.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.147 0.498 . . . . 0.0 110.277 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -64.91 -26.64 68.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.289 178.024 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -41.89 61.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.0 0.428 . . . . 0.0 111.618 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -71.09 -49.82 40.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.625 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.3 t -63.01 -34.86 68.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.379 -177.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -68.86 -35.21 76.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.646 0.26 . . . . 0.0 111.25 178.524 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.99 -26.06 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.643 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.0 -35.66 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.501 ' HA ' ' SD ' ' A' ' 22' ' ' MET . 0.8 OUTLIER -74.64 -19.23 60.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.658 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.24 -24.81 59.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.474 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.401 ' O ' ' HD3' ' A' ' 103' ' ' ARG . 8.8 t70 -87.47 17.86 4.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.915 0.388 . . . . 0.0 111.943 -175.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.501 ' SD ' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -144.79 165.2 28.76 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.121 -0.362 . . . . 0.0 111.462 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.1 t -84.03 104.51 12.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.544 174.648 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.649 ' HB3' ' HG2' ' A' ' 114' ' ' GLU . 0.7 OUTLIER -82.6 114.05 20.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.212 0.529 . . . . 0.0 110.85 -175.267 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.469 ' HA ' HD23 ' A' ' 25' ' ' LEU . 3.3 mt -122.98 147.05 47.07 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.252 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.6 142.9 78.1 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.177 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.741 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 4.9 Cg_endo -47.59 -31.05 13.31 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.551 2.834 . . . . 0.0 113.553 -178.205 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -74.05 -41.5 61.66 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 122.188 -0.32 . . . . 0.0 110.763 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HB3' HD13 ' A' ' 25' ' ' LEU . 1.5 m-20 -62.48 -37.44 85.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.233 175.229 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.13 -46.85 60.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.945 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.649 ' HA ' HD12 ' A' ' 34' ' ' LEU . 88.0 t80 -66.67 -31.46 72.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.945 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -53.0 63.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.001 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.451 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.3 OUTLIER -71.03 -26.31 63.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.896 177.701 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.649 HD12 ' HA ' ' A' ' 31' ' ' TYR . 7.1 mt -60.14 -55.36 34.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.24 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.473 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 0.2 OUTLIER -73.49 -32.11 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.282 -176.974 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -77.33 -28.59 53.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.95 0.405 . . . . 0.0 111.077 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -125.85 100.7 30.51 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.736 -177.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.19 0.65 3.07 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.028 2.485 . . . . 0.0 112.887 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.68 -24.77 20.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.249 0.547 . . . . 0.0 109.814 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.693 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 55.8 mt -89.11 107.24 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.26 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.561 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.3 OUTLIER -95.11 145.37 25.04 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.513 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 88' ' ' PHE . 5.8 tp -103.36 130.04 50.56 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 92.3 mt -113.83 120.47 63.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.676 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.806 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -102.16 132.35 48.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.437 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -113.84 99.5 8.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.136 -178.664 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.636 ' HD2' ' OE2' ' A' ' 50' ' ' GLU . 3.9 mmt180 -156.51 -177.2 6.42 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.639 ' HB3' ' HD2' ' A' ' 48' ' ' PRO . 63.3 m-20 -111.35 168.98 6.8 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.639 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 55.9 Cg_endo -77.84 -23.44 9.44 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 121.863 1.709 . . . . 0.0 114.454 -168.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.69 -49.64 51.54 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.141 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.636 ' OE2' ' HD2' ' A' ' 46' ' ' ARG . 11.5 pm0 -70.25 -33.53 71.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.576 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.627 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.9 OUTLIER -62.73 -37.33 86.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.117 178.123 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -37.31 84.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.35 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.64 -50.56 10.47 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -172.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -100.3 -33.57 10.35 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.139 -174.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 176.47 14.56 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.799 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.627 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -143.89 158.42 56.05 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.407 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 15.6 Cg_endo -62.83 138.45 68.89 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 121.996 1.797 . . . . 0.0 112.589 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.406 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 3.6 t70 -112.41 94.05 4.74 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.686 177.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.729 HG22 ' HB2' ' A' ' 62' ' ' TYR . 2.0 m -131.95 162.61 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.303 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -55.17 -45.56 75.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.045 -176.996 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.561 ' HB2' HG23 ' A' ' 41' ' ' THR . 14.0 p30 -122.56 73.48 1.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.76 0.79 . . . . 0.0 111.027 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.806 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.6 t80 -114.95 128.41 56.27 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.981 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HE2' HG21 ' A' ' 41' ' ' THR . 3.4 mtmt -120.46 121.44 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.807 0.337 . . . . 0.0 110.444 177.377 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -90.14 116.17 27.94 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 176.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.838 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.676 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.831 -175.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.789 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.844 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.68 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 0.4 OUTLIER -49.32 -64.84 1.0 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.041 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.68 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 11.4 Cg_exo -73.86 -17.26 22.83 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.205 1.937 . . . . 0.0 113.219 -176.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.838 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.6 OUTLIER -91.52 -29.01 17.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -173.595 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.68 HD12 HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -62.42 -29.81 70.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.299 0.571 . . . . 0.0 111.411 -177.849 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.562 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -71.18 -32.75 69.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.697 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.82 -15.33 42.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -174.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -27.39 59.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 -176.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.1 61.07 0.86 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.601 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.68 HD13 HD12 ' A' ' 74' ' ' LEU . 11.1 mt -114.54 146.08 41.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.744 0.307 . . . . 0.0 110.688 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -136.71 150.23 69.43 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.419 176.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.65 17.01 0.47 Allowed 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 123.008 2.472 . . . . 0.0 113.667 -175.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.73 -1.28 19.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.155 0.503 . . . . 0.0 109.765 174.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 9.5 mmtm -100.06 128.73 30.03 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.047 -177.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.693 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 4.7 Cg_exo -74.83 122.17 7.11 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.565 2.177 . . . . 0.0 110.103 173.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.441 HG23 HD12 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -127.32 149.48 32.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 120.988 0.423 . . . . 0.0 111.132 -174.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -122.34 137.88 54.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.246 175.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.539 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 6.4 m -105.81 134.1 48.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.947 ' HB2' HD11 ' A' ' 42' ' ' LEU . 24.9 t80 -118.23 144.15 45.99 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.424 -173.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.472 0.642 0 C-N-CA 123.766 0.826 . . . . 0.0 110.747 -175.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.539 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.462 0.144 0 CA-C-O 121.173 0.511 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.26 -36.72 76.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.556 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 97' ' ' LEU . 3.4 mm? -70.44 -30.05 66.79 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.363 176.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.83 -41.45 52.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.739 -177.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.63 -44.17 3.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.665 -171.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.41 ' HB3' ' CE ' ' A' ' 22' ' ' MET . 0.0 OUTLIER -65.26 -23.72 67.12 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.642 -0.328 . . . . 0.0 111.516 -174.858 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -54.24 14.81 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.131 0.491 . . . . 0.0 111.252 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.624 ' HB2' HD13 ' A' ' 110' ' ' ILE . 57.0 mt -56.27 -38.17 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.198 -172.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.05 -31.21 70.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.121 -179.567 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.86 -8.65 58.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.851 0.357 . . . . 0.0 110.938 176.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.594 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 16.7 m-30 -92.77 -38.28 11.88 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.09 50.94 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.476 -0.868 . . . . 0.0 112.583 174.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.426 ' CE1' HD22 ' A' ' 102' ' ' LEU . 2.2 m-85 -92.92 159.73 15.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.617 0.246 . . . . 0.0 110.623 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -69.02 0.39 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.466 -177.079 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.05 117.4 12.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.981 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.624 HD13 ' HB2' ' A' ' 102' ' ' LEU . 1.0 OUTLIER -119.16 128.84 75.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.217 0.532 . . . . 0.0 110.948 -179.578 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -119.27 152.28 36.96 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.544 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -121.98 148.48 44.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.453 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 5.8 m -89.11 113.47 24.63 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -174.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.649 ' HG2' ' HB3' ' A' ' 24' ' ' MET . 1.0 OUTLIER -64.45 143.45 57.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.623 177.646 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 96.0 -104.93 3.17 Favored Glycine 0 N--CA 1.443 -0.854 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 171.11 -165.07 38.19 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' MET . . . . . 0.577 ' HA ' ' CZ ' ' A' ' 88' ' ' PHE . 9.5 tpt -65.41 -29.48 70.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.036 178.038 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -61.71 -28.77 69.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.002 178.457 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.741 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -73.56 -33.01 64.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 111.447 0.165 . . . . 0.0 111.447 -178.929 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.854 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 18.8 t-105 -61.33 -54.54 42.59 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.828 0.347 . . . . 0.0 110.069 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 121' ' ' LEU . 7.2 mt -62.89 -41.88 99.58 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.892 178.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.587 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.5 OUTLIER -65.33 -40.52 93.8 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.159 -177.007 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.601 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.7 tp10 -73.18 -4.89 35.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.918 0.39 . . . . 0.0 111.159 -177.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.49 27.33 63.63 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.771 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.601 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 97.1 mt -79.76 157.67 74.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 -178.646 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.405 ' HB2' ' O ' ' A' ' 58' ' ' ASP . 20.6 Cg_endo -57.09 120.36 8.23 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 123.299 2.666 . . . . 0.0 112.209 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.47 151.77 50.6 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.483 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.406 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 0.8 OUTLIER -100.52 107.87 19.67 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 176.506 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.385 -175.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.23 0 CA-C-O 120.628 0.252 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' GLY . . . . . 0.76 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.67 -32.86 70.31 Favored Glycine 0 C--O 1.223 -0.541 0 CA-C-N 116.055 -0.52 . . . . 0.0 112.195 178.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.12 -31.61 62.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.059 0.457 . . . . 0.0 110.599 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -69.35 -57.19 5.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.076 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.76 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 3.8 p90 -72.56 -26.64 61.81 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.039 -0.664 . . . . 0.0 111.089 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ASP . . . . . 0.562 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 0.3 OUTLIER -53.59 -42.78 67.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.556 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.07 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.995 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.82 -45.06 83.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.706 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 11' ' ' PHE . . . . . 0.594 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 0.1 OUTLIER -55.9 -46.94 78.23 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.307 0.575 . . . . 0.0 110.345 177.168 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 12' ' ' LYS . . . . . 0.642 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.24 -27.5 69.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.397 178.757 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.03 58.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.177 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -70.96 -50.61 32.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.465 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.477 HG21 ' HG2' ' A' ' 71' ' ' GLU . 0.9 OUTLIER -63.46 -33.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.949 -178.442 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.642 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -59.9 -39.36 85.09 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.573 0.225 . . . . 0.0 111.551 178.412 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.78 -26.39 68.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.977 0.418 . . . . 0.0 111.205 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.54 65.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.492 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -24.94 42.41 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.164 0.507 . . . . 0.0 111.128 173.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.61 -15.75 41.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.166 -173.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.98 -23.27 62.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -171.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' MET . . . . . 0.409 ' SD ' ' HB2' ' B' ' 112' ' ' ASN . 1.5 ptp -139.7 172.87 12.16 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.811 -177.135 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 22.9 t -67.27 109.55 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.553 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -83.43 121.16 26.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.251 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 25' ' ' LEU . . . . . 0.484 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.5 mt -129.5 141.63 50.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.9 -177.814 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.52 145.7 82.65 Favored Pre-proline 0 C--N 1.315 -0.934 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.552 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 1.3 Cg_endo -45.22 -29.74 4.57 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.01 3.14 . . . . 0.0 114.415 -175.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -44.84 49.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 111.143 177.048 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -29.9 68.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.472 178.222 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' B' ' 86' ' ' VAL . . . -74.35 -42.31 59.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.651 177.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' TYR . . . . . 0.507 ' CZ ' ' HG3' ' B' ' 126' ' ' PRO . 38.8 t80 -64.25 -40.59 96.33 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.036 0.446 . . . . 0.0 110.806 178.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 36' ' ' GLU . 0.1 OUTLIER -50.3 -53.76 26.26 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.262 -177.421 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.597 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.3 OUTLIER -74.94 -27.57 60.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.268 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' B' ' 42' ' ' LEU . 3.2 mt -63.85 -57.52 9.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.146 0.498 . . . . 0.0 112.027 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.28 -18.28 55.49 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.047 -172.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 32' ' ' LYS . 0.4 OUTLIER -98.2 -9.09 26.21 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.588 -176.537 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -133.76 106.74 11.72 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.818 0.342 . . . . 0.0 110.298 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' PRO . . . . . 0.446 ' HA ' HD21 ' B' ' 61' ' ' ASN . 27.6 Cg_exo -65.5 -2.73 6.57 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.23 2.62 . . . . 0.0 113.696 -176.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.54 -25.91 18.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.431 . . . . 0.0 110.115 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.597 HD12 ' HB2' ' B' ' 33' ' ' LEU . 9.1 mt -82.62 108.09 15.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.412 178.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.664 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -101.57 144.83 29.84 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.093 -177.681 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.93 HD11 ' HB2' ' B' ' 88' ' ' PHE . 0.9 OUTLIER -103.96 127.96 51.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.923 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 2.0 mp -108.82 119.58 58.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 175.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.875 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -110.08 136.12 49.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.701 -178.73 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.09 100.05 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.88 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -153.88 152.93 31.2 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.964 -174.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -69.68 135.13 88.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.771 0.319 . . . . 0.0 110.566 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.01 -19.22 68.6 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.084 2.523 . . . . 0.0 113.851 -175.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.32 -40.08 37.75 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.825 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -67.57 -35.21 78.58 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.833 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.7 OUTLIER -60.27 -34.76 74.17 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.66 174.296 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -71.97 -41.74 67.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.834 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.99 -47.77 14.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.151 -172.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 12.4 mtt -102.36 -34.31 9.23 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.607 -173.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.94 178.28 15.45 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.821 176.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' LYS . . . . . 0.833 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 6.6 pttt -135.18 155.3 79.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.86 127.44 25.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.892 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' ASP . . . . . 0.671 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 26.5 t0 -101.99 81.68 2.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.272 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.788 HG22 ' HB2' ' B' ' 62' ' ' TYR . 0.9 OUTLIER -120.13 157.48 22.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.194 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -51.96 63.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.643 -175.136 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.452 ' HB2' ' HA ' ' B' ' 41' ' ' THR . 0.2 OUTLIER -109.82 80.65 1.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 0.0 110.545 -179.241 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 62' ' ' TYR . . . . . 0.875 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.5 t80 -121.32 130.56 53.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.046 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.664 ' HE2' HG21 ' B' ' 41' ' ' THR . 3.9 mttm -129.59 121.86 27.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.364 177.578 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -84.92 111.18 19.44 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 65' ' ' MET . . . . . 0.624 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--N 1.324 -0.505 0 CA-C-O 120.729 0.299 . . . . 0.0 110.289 -177.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.59 HD11 HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.611 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -44.82 -58.23 5.74 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -172.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.611 ' HD3' ' CD ' ' B' ' 71' ' ' GLU . 6.8 Cg_exo -73.52 -16.13 24.38 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.507 2.138 . . . . 0.0 112.818 -179.296 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.624 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -87.87 -19.68 27.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.458 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.651 HD21 HD21 ' B' ' 102' ' ' LEU . 24.2 tp -60.6 -51.42 69.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.701 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.602 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -63.85 -24.0 67.57 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.0 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.76 -22.05 50.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -177.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 77' ' ' SER . . . . . 0.574 ' HB2' ' HG ' ' B' ' 79' ' ' LEU . 0.3 OUTLIER -75.17 -39.65 60.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.803 0.335 . . . . 0.0 110.556 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.71 39.32 6.26 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.925 -177.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.574 ' HG ' ' HB2' ' B' ' 77' ' ' SER . 7.3 mt -83.2 151.75 25.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.602 0.239 . . . . 0.0 110.558 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.475 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.6 OUTLIER -125.48 133.72 25.13 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 81' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 37.4 Cg_exo -64.84 4.38 0.67 Allowed 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 123.502 2.801 . . . . 0.0 113.822 -176.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.37 -2.02 24.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.836 0.35 . . . . 0.0 110.799 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -109.74 146.03 33.21 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.94 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.576 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 7.9 Cg_exo -75.08 143.57 28.96 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 111.832 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.4 OUTLIER -143.74 147.43 19.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.759 -178.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.412 HG21 ' HB1' ' B' ' 30' ' ' ALA . 2.3 p -124.78 139.63 50.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 87' ' ' VAL . . . . . 0.572 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 4.4 m -109.28 124.31 65.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.094 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 88' ' ' PHE . . . . . 0.93 ' HB2' HD11 ' B' ' 42' ' ' LEU . 9.6 t80 -104.4 136.62 43.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.148 -171.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 89' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' B' ' 117' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.67 0 O-C-N 124.291 0.995 . . . . 0.0 111.661 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 95' ' ' ALA . . . . . 0.572 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 120.765 0.317 . . . . 0.0 111.179 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 96' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 112' ' ' ASN . . . -54.77 -29.5 54.21 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.276 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 97' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' B' ' 97' ' ' LEU . 1.9 mm? -70.28 -32.04 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.888 0.375 . . . . 0.0 111.054 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.03 -44.26 55.0 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.01 0.433 . . . . 0.0 110.838 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -80.45 -48.3 6.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.629 -0.796 . . . . 0.0 113.444 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 100' ' ' LYS . . . . . 0.434 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -59.62 -42.74 93.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.809 0.337 . . . . 0.0 111.56 -172.748 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 101' ' ' THR . . . . . 0.434 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 0.7 OUTLIER -69.71 -35.34 74.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.461 -178.094 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 102' ' ' LEU . . . . . 0.651 HD21 HD21 ' B' ' 74' ' ' LEU . 9.2 mt -62.56 -50.42 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.554 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 103' ' ' ARG . . . . . 0.575 ' HB3' HG21 ' B' ' 110' ' ' ILE . 0.9 OUTLIER -65.98 -30.69 71.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.887 0.375 . . . . 0.0 110.597 -179.891 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 104' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' B' ' 103' ' ' ARG . 7.2 mt-10 -71.24 -7.07 44.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.335 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -108.46 -11.51 15.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.746 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 129.74 14.73 2.05 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.017 -1.087 . . . . 0.0 113.89 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 107' ' ' PHE . . . . . 0.57 ' CE1' HD22 ' B' ' 102' ' ' LEU . 4.9 m-85 -70.97 140.23 50.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.399 0.599 . . . . 0.0 110.595 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.43 -81.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.784 -172.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -111.47 103.04 11.36 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.817 -176.213 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 110' ' ' ILE . . . . . 0.575 HG21 ' HB3' ' B' ' 103' ' ' ARG . 1.3 tt -114.47 131.1 67.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.472 0.653 . . . . 0.0 110.889 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -120.28 151.5 39.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.295 -178.378 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.587 HD21 ' HA ' ' B' ' 96' ' ' ALA . 4.6 t-20 -123.1 148.86 45.2 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.594 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 4.8 m -83.54 138.4 33.42 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.443 -177.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -97.39 152.99 18.38 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.117 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.98 -87.93 1.32 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.793 -176.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 150.31 -166.81 30.13 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.033 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 117' ' ' MET . . . . . 0.504 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 7.7 tmm? -67.96 -33.01 73.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.991 0.424 . . . . 0.0 110.66 179.293 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -63.87 -29.63 70.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.634 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 119' ' ' LYS . . . . . 0.552 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -69.14 -33.56 73.63 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.868 -0.151 . . . . 0.0 111.368 177.872 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 120' ' ' TRP . . . . . 0.847 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 34.8 t-105 -60.86 -53.56 55.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 121' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 121' ' ' LEU . 9.5 mt -64.94 -39.73 93.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 178.003 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.569 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.3 OUTLIER -63.94 -34.62 78.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.716 -176.942 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 123' ' ' GLU . . . . . 0.553 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.7 OUTLIER -82.49 -0.85 48.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.939 0.399 . . . . 0.0 111.095 -178.576 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.26 29.38 68.55 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.143 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.553 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 77.6 mt -79.68 160.77 68.8 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.604 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 21.9 Cg_endo -57.42 121.9 10.84 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 123.042 2.495 . . . . 0.0 112.152 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.56 151.14 52.02 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.436 -178.158 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 128' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.1 mt . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.428 ' HG3' ' HB2' ' A' ' 6' ' ' LYS . 2.8 tpp . . . . . 0 C--O 1.232 0.172 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.588 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -55.99 -32.03 59.14 Favored Glycine 0 C--O 1.229 -0.192 0 CA-C-N 116.205 -0.452 . . . . 0.0 112.943 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.19 -33.08 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.75 0.31 . . . . 0.0 111.095 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.428 ' HB2' ' HG3' ' A' ' 3' ' ' MET . 20.1 mmtt -68.9 -58.04 4.69 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -172.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.588 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.6 OUTLIER -72.29 -34.05 67.89 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.468 -173.496 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.72 -57.35 11.17 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 123.309 0.381 . . . . 0.0 110.931 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.66 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m -67.15 -44.94 78.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.255 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 7' ' ' PHE . 0.3 OUTLIER -54.16 -42.96 70.2 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.32 0.581 . . . . 0.0 109.908 178.485 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -65.94 -26.24 67.49 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.904 177.869 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.85 -45.66 49.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.852 0.358 . . . . 0.0 110.914 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -71.77 -50.47 29.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.96 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.746 HG11 ' HG2' ' B' ' 71' ' ' GLU . 0.8 OUTLIER -68.38 -34.19 64.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.464 -172.628 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.539 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -66.53 -27.74 68.0 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.222 -0.299 . . . . 0.0 111.157 -177.973 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.73 66.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.005 0.431 . . . . 0.0 111.187 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.24 70.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.023 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -23.94 49.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.313 0.578 . . . . 0.0 110.93 175.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.77 -20.68 27.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.977 -176.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -32.86 73.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.46 ' HG3' ' HB2' ' A' ' 112' ' ' ASN . 6.6 ptm -125.7 178.73 5.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.98 0.419 . . . . 0.0 111.924 -175.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.0 t -74.58 111.44 10.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.098 -178.493 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.0 mmt -79.89 105.41 11.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.861 -178.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.442 ' HB2' ' HB3' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -113.11 139.63 48.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.096 0.474 . . . . 0.0 110.583 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.7 143.29 67.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.796 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -51.29 -24.33 15.4 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.632 2.888 . . . . 0.0 113.951 -176.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 mtmt -74.29 -43.87 55.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.071 0.462 . . . . 0.0 110.909 177.117 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.45 -29.13 62.35 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.566 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.61 -45.34 62.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.634 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.558 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 74.5 t80 -67.23 -32.02 72.78 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.997 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.8 tptt -56.29 -50.17 72.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.146 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.51 ' O ' ' HB2' ' A' ' 37' ' ' ASN . 0.3 OUTLIER -74.23 -27.53 60.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.678 177.648 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.641 HD11 ' HB2' ' A' ' 42' ' ' LEU . 2.5 mt -64.23 -48.27 76.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.027 0.441 . . . . 0.0 111.379 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -21.93 57.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.416 -175.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.98 -27.89 15.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 111.232 -177.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 5.9 m-80 -112.24 108.91 54.58 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.515 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -71.39 0.57 6.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 122.779 2.319 . . . . 0.0 112.037 177.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.72 -26.44 13.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.586 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.837 HG12 ' HG2' ' A' ' 84' ' ' PRO . 36.7 mt -80.66 113.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.73 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.79 144.06 31.98 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 -177.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.997 HD11 ' HB2' ' A' ' 88' ' ' PHE . 27.2 tp -96.56 121.41 38.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 88.2 mt -103.18 111.11 31.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.777 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -104.73 140.85 37.47 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' VAL . . . . . 0.408 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -124.18 98.22 5.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.489 177.549 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.552 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -144.19 149.17 35.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.404 179.249 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.552 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 4.5 m-20 -67.67 141.17 94.88 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.039 -175.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -58.13 -25.75 72.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.546 2.831 . . . . 0.0 114.464 -169.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.21 -43.48 57.01 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.974 -0.69 . . . . 0.0 111.955 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 46' ' ' ARG . 27.2 tt0 -65.1 -35.37 80.9 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.857 176.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.659 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -57.38 -35.42 69.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.72 176.353 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.5 mtpt -79.61 -43.54 22.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.253 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -91.12 -48.07 7.17 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.833 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 mtm -95.56 -35.1 11.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.339 -174.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.69 171.03 12.9 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 113.641 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.659 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -142.49 162.35 45.12 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -62.83 132.44 37.3 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 121.934 1.756 . . . . 0.0 112.679 -176.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' A' ' 126' ' ' PRO . 20.0 t0 -107.37 77.41 1.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.068 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.448 HG22 ' HB2' ' A' ' 62' ' ' TYR . 3.0 m -119.3 166.78 13.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.6 -41.16 93.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.982 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 86.0 2.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.033 0.444 . . . . 0.0 111.036 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.777 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.0 OUTLIER -128.98 132.81 47.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.56 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.95 119.78 32.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.473 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -86.68 118.73 26.28 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 175.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.738 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.637 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.264 -174.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.738 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.894 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.795 ' HG2' HG11 ' B' ' 15' ' ' VAL . 0.2 OUTLIER -44.05 -61.82 1.82 Allowed Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -172.952 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.606 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 7.6 Cg_exo -73.86 -15.85 23.59 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.448 2.098 . . . . 0.0 113.146 -178.038 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.6 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.1 OUTLIER -90.01 -19.08 24.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.908 0.385 . . . . 0.0 110.874 -177.951 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.495 ' CD1' HD21 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -73.14 -28.94 62.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.385 0.612 . . . . 0.0 110.43 -179.615 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.56 -28.28 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.958 173.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -18.06 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.943 -177.144 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -41.3 27.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.969 0.414 . . . . 0.0 110.281 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.85 55.34 1.15 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.395 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.9 mt -94.32 145.22 24.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.665 0.269 . . . . 0.0 110.493 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -127.1 158.1 70.08 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.546 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 45.5 Cg_endo -70.93 9.16 0.84 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.89 2.393 . . . . 0.0 114.158 -174.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.406 ' H ' ' HG3' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -118.06 -1.9 11.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.824 0.345 . . . . 0.0 110.585 179.062 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.3 mmtm -88.53 134.6 33.89 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.29 -176.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.837 ' HG2' HG12 ' A' ' 40' ' ' ILE . 27.9 Cg_endo -88.29 124.31 1.7 Allowed 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.05 2.5 . . . . 0.0 111.261 175.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.508 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -135.35 149.92 28.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 111.205 -176.079 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -124.29 141.2 45.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.916 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 8.0 m -106.91 133.53 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.997 ' HB2' HD11 ' A' ' 42' ' ' LEU . 14.4 t80 -116.97 137.2 52.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.935 -171.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 117' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.672 0 O-C-N 124.407 1.067 . . . . 0.0 112.034 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.916 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 C--O 1.229 -0.022 0 CA-C-O 120.907 0.384 . . . . 0.0 111.242 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.453 ' HA ' ' ND2' ' A' ' 112' ' ' ASN . . . -58.64 -34.94 71.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.194 179.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -67.11 -30.41 70.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.866 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.52 -40.6 49.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.791 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -96.86 -40.8 3.72 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.852 -171.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -25.02 67.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.847 0.356 . . . . 0.0 111.24 -174.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.59 -49.67 38.19 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.842 177.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.495 HD21 ' CD1' ' A' ' 74' ' ' LEU . 22.8 mt -57.79 -42.21 83.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.682 -174.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.412 ' HD3' ' HB3' ' A' ' 22' ' ' MET . 0.0 OUTLIER -68.68 -26.62 65.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.84 0.352 . . . . 0.0 110.742 178.314 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.71 -8.39 57.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.226 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.477 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 14.2 m-85 -105.26 -42.05 5.37 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 176.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 142.53 85.32 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.349 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.453 ' CE1' HD22 ' A' ' 102' ' ' LEU . 1.5 m-85 -126.44 156.75 40.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.605 0.24 . . . . 0.0 110.601 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -71.29 0.24 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.354 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.45 111.94 9.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.05 -177.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.508 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 1.5 tt -122.92 128.94 75.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.304 0.573 . . . . 0.0 111.062 -178.568 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.442 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 0.9 OUTLIER -117.52 149.84 39.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.501 -177.206 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.46 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 8.1 t-20 -118.63 144.77 45.93 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.454 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 92.0 p -81.56 135.57 35.58 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.137 0.494 . . . . 0.0 111.95 -171.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.49 136.74 33.3 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.617 169.435 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 87.07 -127.13 8.28 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.271 -172.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -178.75 -159.96 23.98 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' MET . . . . . 0.464 ' HB2' ' SG ' ' A' ' 89' ' ' CYS . 0.0 OUTLIER -58.78 -33.79 70.71 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.401 . . . . 0.0 110.712 178.663 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ASP . . . . . 0.478 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.25 -34.37 72.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.962 178.465 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.451 ' HD2' ' OD1' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -73.93 -32.14 63.38 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.488 0.185 . . . . 0.0 111.174 -179.385 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.749 ' HB2' ' HZ ' ' A' ' 88' ' ' PHE . 18.6 t-105 -62.39 -54.28 42.58 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 121' ' ' LEU . 2.2 mt -63.77 -42.4 97.78 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.7 0.286 . . . . 0.0 111.045 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 2.1 tt0 -62.1 -40.98 97.69 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.793 -177.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.545 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.8 OUTLIER -77.78 -0.72 28.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 69.12 29.67 72.14 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.925 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.545 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 75.2 mt -77.4 158.42 79.15 Favored Pre-proline 0 N--CA 1.45 -0.472 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.545 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 19.7 Cg_endo -55.31 114.41 1.86 Allowed 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 123.262 2.642 . . . . 0.0 112.129 -179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.78 152.9 51.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.073 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.0 mt -102.96 100.5 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.317 -0.815 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.775 -178.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' MET . . . . . 0.546 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mpp? . . . . . 0 N--CA 1.453 -0.292 0 CA-C-O 120.647 0.261 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' GLY . . . . . 0.585 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.85 -33.7 69.11 Favored Glycine 0 C--O 1.226 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.52 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -31.25 62.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.864 0.364 . . . . 0.0 111.143 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.461 ' HG3' ' HA ' ' B' ' 3' ' ' MET . 4.8 mmtt -72.29 -58.06 3.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.269 -172.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.585 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.1 p90 -73.69 -27.09 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.26 -175.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -47.12 69.38 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.425 0.453 . . . . 0.0 110.425 -177.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.9 -43.55 86.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.322 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -42.97 77.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.75 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 11' ' ' PHE . . . . . 0.477 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 1.0 OUTLIER -55.33 -48.76 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.307 0.575 . . . . 0.0 110.398 178.101 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 12' ' ' LYS . . . . . 0.646 ' HE2' ' HB2' ' A' ' 71' ' ' GLU . 1.8 tppt? -65.8 -26.05 67.52 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.94 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.19 -41.63 63.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.143 0.497 . . . . 0.0 111.061 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.55 -49.14 43.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.272 177.652 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.795 HG11 ' HG2' ' A' ' 71' ' ' GLU . 1.2 t -64.45 -34.35 68.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.03 -174.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.584 ' HD2' ' HG3' ' B' ' 12' ' ' LYS . 0.2 OUTLIER -68.35 -38.9 81.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.692 0.282 . . . . 0.0 111.187 -178.814 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.27 -32.32 68.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.806 -177.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.81 73.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.141 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.43 -23.77 42.94 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.456 0.646 . . . . 0.0 110.803 173.607 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.67 -14.01 46.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.957 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -73.99 -20.39 60.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.115 -174.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' MET . . . . . 0.593 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 3.4 ptm -122.45 177.77 5.26 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.91 0.386 . . . . 0.0 111.503 -178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.9 t -74.49 110.62 9.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.595 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.03 109.08 14.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.688 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' B' ' 25' ' ' LEU . 2.7 mt -112.16 -168.76 1.36 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.052 0.453 . . . . 0.0 110.513 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 1.1 p -129.82 144.61 53.7 Favored Pre-proline 0 C--N 1.321 -0.67 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.424 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 7.9 Cg_endo -52.76 -17.18 6.82 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 123.34 2.693 . . . . 0.0 113.817 -176.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -73.05 -47.08 47.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.946 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.47 -33.22 42.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.725 178.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.537 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -64.21 -47.02 81.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.579 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 31' ' ' TYR . . . . . 0.672 ' HA ' HD12 ' B' ' 34' ' ' LEU . 39.0 t80 -66.92 -30.95 71.23 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.714 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -47.15 87.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.666 0.27 . . . . 0.0 111.32 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.608 HD13 HG21 ' B' ' 40' ' ' ILE . 0.3 OUTLIER -70.03 -26.57 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.088 -0.245 . . . . 0.0 110.991 178.934 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.672 HD12 ' HA ' ' B' ' 31' ' ' TYR . 51.7 mt -72.43 -45.36 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 110.705 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -73.59 -24.12 60.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.094 -174.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -105.13 -9.59 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' ASN . . . . . 0.555 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 42.7 m-20 -129.47 111.18 17.8 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.731 0.3 . . . . 0.0 110.525 178.273 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -71.9 -1.63 10.25 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.155 2.57 . . . . 0.0 112.801 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -105.78 -26.31 11.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.542 -177.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.608 HG21 HD13 ' B' ' 33' ' ' LEU . 36.1 mt -77.53 110.58 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 175.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -100.64 144.67 29.34 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.791 -173.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.841 HD11 ' HB2' ' B' ' 88' ' ' PHE . 3.1 tp -104.85 125.31 50.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.3 mp -104.34 114.05 42.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 175.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.827 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -102.8 133.9 47.08 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.446 -178.849 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 45' ' ' VAL . . . . . 0.493 ' O ' ' HG2' ' B' ' 46' ' ' ARG . 0.1 OUTLIER -122.13 97.86 5.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.547 -178.615 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 46' ' ' ARG . . . . . 0.493 ' HG2' ' O ' ' B' ' 45' ' ' VAL . 0.0 OUTLIER -149.21 164.35 35.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.731 -178.54 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -71.55 137.01 83.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.668 0.271 . . . . 0.0 110.961 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.04 -26.68 58.02 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.688 2.258 . . . . 0.0 113.54 -177.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' ASP . . . . . 0.653 ' HA ' ' HD3' ' B' ' 52' ' ' LYS . 4.2 t0 -78.39 -33.25 48.94 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.233 176.521 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 50' ' ' GLU . . . . . 0.482 ' CD ' HH21 ' B' ' 46' ' ' ARG . 3.5 mt-10 -65.14 -34.76 79.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.073 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.872 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 mp -65.42 -35.12 79.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.432 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' LYS . . . . . 0.653 ' HD3' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -69.62 -39.97 76.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.436 178.324 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.11 -48.31 13.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 112.609 -173.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -97.52 -35.01 10.78 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.492 -172.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.12 172.72 14.93 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.91 -0.662 . . . . 0.0 111.794 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' LYS . . . . . 0.872 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 11.9 pttt -140.47 155.31 69.91 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 57' ' ' PRO . . . . . 0.407 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 11.8 Cg_endo -59.02 124.26 15.29 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.51 2.14 . . . . 0.0 112.684 -177.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 58' ' ' ASP . . . . . 0.711 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 33.8 t0 -97.25 73.76 2.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.344 0.592 . . . . 0.0 110.486 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.624 HG22 ' HB2' ' B' ' 62' ' ' TYR . 2.8 m -113.31 171.26 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -30.07 55.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.979 0.419 . . . . 0.0 111.364 -174.818 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -122.55 65.23 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.649 -177.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 62' ' ' TYR . . . . . 0.827 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 1.2 t80 -114.85 125.29 53.5 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.477 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.424 ' HB3' ' HE1' ' B' ' 65' ' ' MET . 2.1 mttt -123.55 119.59 30.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -80.93 115.48 20.42 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 65' ' ' MET . . . . . 0.773 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.579 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.704 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.746 ' HG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -45.39 -60.71 2.98 Favored Pre-proline 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.16 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 11.8 Cg_exo -73.24 -16.09 25.16 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.576 2.184 . . . . 0.0 113.225 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.773 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -85.53 -15.79 41.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.142 -175.805 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.949 HD21 HD21 ' B' ' 102' ' ' LEU . 9.5 tp -58.56 -49.19 78.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.262 0.553 . . . . 0.0 110.807 -179.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.32 -26.57 66.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.333 -179.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -74.43 -29.59 61.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.009 -175.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.54 -34.51 67.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 111.096 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.91 50.47 2.86 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.59 -0.815 . . . . 0.0 111.284 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 20.0 mt -97.23 148.42 23.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.778 0.323 . . . . 0.0 110.614 -178.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.462 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.5 OUTLIER -136.38 137.54 24.57 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.538 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 81' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 30.1 Cg_exo -67.23 24.17 0.11 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.416 2.744 . . . . 0.0 114.222 -174.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.6 4.01 23.52 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.33 0.586 . . . . 0.0 109.793 174.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 83' ' ' LYS . . . . . 0.453 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.2 mttp -119.17 132.86 23.8 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.16 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' B' ' 83' ' ' LYS . 6.1 Cg_exo -69.62 143.01 50.15 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.453 2.102 . . . . 0.0 110.865 174.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.557 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 2.1 m -141.47 151.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -176.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.481 HG23 ' HB2' ' B' ' 111' ' ' TYR . 2.8 p -127.46 142.79 42.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 175.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 87' ' ' VAL . . . . . 0.806 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 18.6 m -104.93 157.9 5.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 88' ' ' PHE . . . . . 0.841 ' HB2' HD11 ' B' ' 42' ' ' LEU . 4.4 t80 -122.99 111.4 16.56 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 125.171 1.389 . . . . 0.0 112.781 176.252 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 95' ' ' ALA . . . . . 0.806 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 C--O 1.226 -0.163 0 CA-C-O 120.94 0.4 . . . . 0.0 110.807 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.16 67.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 178.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 97' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' B' ' 97' ' ' LEU . 2.1 mm? -76.27 -28.07 56.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.271 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 98' ' ' ALA . . . . . 0.611 ' HA ' HD21 ' B' ' 70' ' ' LEU . . . -72.44 -30.94 65.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.321 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 99' ' ' GLY . . . . . 0.449 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -103.76 -46.22 1.42 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.727 -174.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 100' ' ' LYS . . . . . 0.429 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -62.46 -33.12 74.2 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.571 -0.37 . . . . 0.0 111.142 -174.832 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 101' ' ' THR . . . . . 0.429 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 1.2 m -73.46 -36.29 65.83 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.941 0.4 . . . . 0.0 111.061 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 102' ' ' LEU . . . . . 0.949 HD21 HD21 ' B' ' 74' ' ' LEU . 5.6 mt -67.78 -38.53 83.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.258 -176.037 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -26.13 67.25 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.917 0.389 . . . . 0.0 110.612 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.43 -5.58 50.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.273 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 105' ' ' TYR . . . . . 0.417 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 22.0 m-30 -105.8 -8.14 17.93 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.078 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 123.73 5.05 7.81 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.012 -1.09 . . . . 0.0 113.734 171.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 107' ' ' PHE . . . . . 0.418 ' CE1' HD22 ' B' ' 102' ' ' LEU . 8.7 m-85 -69.4 130.54 42.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 117.034 0.417 . . . . 0.0 110.589 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -57.58 -80.76 0.02 OUTLIER 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.087 -172.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.06 115.7 26.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.968 -177.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 110' ' ' ILE . . . . . 0.557 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.4 tt -118.92 127.37 75.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.604 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 111' ' ' TYR . . . . . 0.481 ' HB2' HG23 ' B' ' 86' ' ' VAL . 4.7 m-85 -113.39 144.5 42.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.387 -175.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.593 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 17.9 t-20 -117.62 143.41 46.16 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.146 -0.686 . . . . 0.0 109.146 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.611 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -83.06 134.32 35.03 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.633 -175.869 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.69 153.91 20.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.826 -1.079 . . . . 0.0 108.373 164.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 115' ' ' GLY . . . . . 0.597 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 82.9 -108.44 2.98 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 -173.079 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.15 -156.14 27.35 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.75 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 1.6 ttt -61.43 -35.21 76.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.961 0.41 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.8 -38.57 75.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.639 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 119' ' ' LYS . . . . . 0.597 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -66.46 -33.21 75.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.805 -179.495 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 120' ' ' TRP . . . . . 0.679 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 30.7 t-105 -59.99 -53.62 55.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 121' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' B' ' 121' ' ' LEU . 12.8 mt -64.31 -39.69 94.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.861 177.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -61.59 -40.64 95.5 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.957 0.408 . . . . 0.0 111.369 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -74.05 -12.49 60.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.802 -179.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.2 56.98 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.572 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.45 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 83.7 mt -80.34 159.3 70.35 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.273 . . . . 0.0 110.607 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 14.3 Cg_endo -54.57 119.36 6.29 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 123.09 2.526 . . . . 0.0 112.163 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.48 152.75 51.42 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.316 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 128' ' ' LEU . . . . . 0.711 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 3.2 mt . . . . . 0 C--N 1.32 -0.703 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 111.563 0.208 . . . . 0.0 111.563 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.603 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -63.61 -52.27 47.4 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.041 178.689 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -59.75 -32.46 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.528 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -66.42 -57.51 7.24 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.055 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.603 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.3 OUTLIER -84.28 -22.7 30.64 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -175.624 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.627 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 17.5 t70 -54.27 -41.94 69.41 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 111.023 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.83 -37.7 67.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.137 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -43.11 82.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.475 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.412 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.8 OUTLIER -58.18 -41.68 84.43 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.093 -179.309 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.594 ' HE2' ' HG3' ' B' ' 72' ' ' PRO . 12.2 tptp -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.164 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.97 -46.34 30.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.492 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -70.59 -51.86 25.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.798 -176.017 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.47 -34.32 50.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.898 0.38 . . . . 0.0 110.865 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.5 tptm -62.08 -36.08 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.395 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.62 -26.01 68.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.281 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.83 -31.91 71.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.656 176.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 7.2 mtpp -75.86 -21.06 57.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.46 0.648 . . . . 0.0 110.819 173.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.46 46.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.279 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -75.64 -15.28 60.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.889 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.686 ' HG3' HG23 ' A' ' 110' ' ' ILE . 1.5 mpp? -121.58 -179.45 4.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.965 0.412 . . . . 0.0 111.237 -177.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.5 t -88.22 105.81 15.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.61 175.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.801 ' HG3' ' HG2' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -73.45 100.04 3.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.856 0.36 . . . . 0.0 110.29 -177.627 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.493 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -116.27 142.51 46.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.193 0.52 . . . . 0.0 111.127 -175.743 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.18 138.41 48.96 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.853 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.58 ' HA ' ' HB3' ' A' ' 30' ' ' ALA . 10.1 Cg_endo -52.65 -14.46 3.28 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.697 2.932 . . . . 0.0 114.308 -176.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.42 -45.78 52.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.836 0.351 . . . . 0.0 110.795 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.0 OUTLIER -79.6 -33.34 41.64 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.544 176.175 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.58 ' HB3' ' HA ' ' A' ' 27' ' ' PRO . . . -62.43 -39.52 93.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.453 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.498 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 63.5 t80 -74.19 -32.56 63.12 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -51.55 67.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.683 ' HB2' HD12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -73.85 -27.54 61.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.72 0.295 . . . . 0.0 110.864 178.509 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.855 HD11 ' HB2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.55 -50.59 72.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.207 0.527 . . . . 0.0 110.838 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -27.5 56.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -76.75 -31.9 57.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.77 0.319 . . . . 0.0 111.067 -177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASN . . . . . 0.76 ' HB2' HG13 ' A' ' 40' ' ' ILE . 44.6 m-20 -119.73 114.42 34.15 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.842 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 15.6 Cg_exo -68.74 -0.27 5.86 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.197 2.598 . . . . 0.0 112.925 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -105.36 -18.48 14.1 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.193 179.551 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.82 HG12 ' HG2' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -74.27 114.37 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.615 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.529 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -107.64 140.04 41.26 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.793 -177.085 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.855 ' HB2' HD11 ' A' ' 34' ' ' LEU . 10.7 tp -103.93 120.92 42.04 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.562 HD11 HD21 ' A' ' 79' ' ' LEU . 1.3 mp -104.35 113.74 42.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.639 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 2.2 t70 -102.47 140.25 37.0 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.725 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -122.75 93.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.622 0.725 . . . . 0.0 109.777 173.129 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.417 HH12 ' CD ' ' A' ' 50' ' ' GLU . 11.9 mmm180 -143.27 152.64 41.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.415 178.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.94 142.07 64.29 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.498 -173.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -59.86 -25.28 78.92 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 123.37 2.714 . . . . 0.0 113.565 -172.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.81 -38.45 46.47 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.212 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.417 ' CD ' HH12 ' A' ' 46' ' ' ARG . 0.4 OUTLIER -72.91 -37.44 67.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 175.268 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.968 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.3 tp -59.35 -33.31 71.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.519 174.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -37.59 60.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.132 178.044 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.48 -49.66 13.02 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -174.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -100.11 -35.8 9.55 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.289 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.15 178.48 15.33 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.459 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.968 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -140.58 154.06 68.83 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.902 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.429 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.6 Cg_endo -61.38 123.27 12.46 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 121.976 1.784 . . . . 0.0 112.674 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 46.7 t0 -86.54 93.56 9.21 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 174.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 1.041 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -129.84 151.42 35.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.234 -177.466 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.87 76.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.172 0.51 . . . . 0.0 110.911 -178.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -116.95 66.84 0.72 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.356 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 1.041 ' HB2' HG23 ' A' ' 59' ' ' VAL . 12.2 t80 -108.38 122.52 47.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.611 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.529 ' HE2' HG21 ' A' ' 41' ' ' THR . 18.9 mttm -122.83 109.31 14.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -93.11 114.53 27.07 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' MET . . . . . 0.547 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 CA-C-O 120.841 0.353 . . . . 0.0 110.326 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.531 ' HG ' ' N ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.531 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -47.31 -53.89 25.49 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.369 -175.626 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.504 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 73.9 Cg_endo -73.76 -16.73 23.44 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.076 1.851 . . . . 0.0 112.983 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.547 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -88.44 -15.74 34.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.671 0.272 . . . . 0.0 111.021 -177.809 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.887 HD21 HD21 ' A' ' 102' ' ' LEU . 6.3 tp -58.42 -53.49 57.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.176 0.512 . . . . 0.0 111.024 -178.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.47 -27.06 62.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.317 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.6 -28.79 62.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.84 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.509 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 41.2 m -77.41 -38.08 50.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.14 0.495 . . . . 0.0 109.957 178.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.24 81.25 1.58 Allowed Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.269 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.562 HD21 HD11 ' A' ' 43' ' ' ILE . 29.1 mt -122.36 148.64 44.82 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.476 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -128.06 138.93 34.0 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -70.54 -0.82 8.14 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 122.919 2.413 . . . . 0.0 114.266 -170.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.563 ' HA ' ' HG3' ' A' ' 108' ' ' LYS . 38.3 mm-40 -100.03 9.34 43.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.133 0.492 . . . . 0.0 109.997 175.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.476 ' HG3' ' OD2' ' A' ' 80' ' ' ASP . 7.2 mttm -102.82 128.11 28.58 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.235 -178.165 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.82 ' HG2' HG12 ' A' ' 40' ' ' ILE . 72.9 Cg_endo -72.96 122.06 7.81 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.409 2.072 . . . . 0.0 110.806 174.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.474 HG12 ' HB ' ' A' ' 41' ' ' THR . 1.8 m -130.56 152.62 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.029 0.443 . . . . 0.0 111.371 -173.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.607 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 1.2 p -127.07 142.49 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 16.4 m -104.33 135.82 40.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.124 0.488 . . . . 0.0 110.556 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.823 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.9 t80 -119.48 144.65 46.88 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.753 -177.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' CYS . . . . . 0.626 ' HB3' ' HB2' ' A' ' 95' ' ' ALA . 52.7 t . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.446 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.626 ' HB2' ' HB3' ' A' ' 89' ' ' CYS . . . . . . . . 0 CA--C 1.527 0.065 0 CA-C-O 121.117 0.484 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.71 -27.91 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.174 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.453 HD21 HD21 ' B' ' 97' ' ' LEU . 2.8 mm? -67.59 -35.27 78.67 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.407 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.73 -45.63 50.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.913 0.387 . . . . 0.0 110.427 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -70.21 -53.45 13.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.57 -177.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -62.3 -35.81 80.19 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.704 -0.292 . . . . 0.0 111.408 -174.245 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.504 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 23.4 m -70.75 -35.57 72.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.826 0.346 . . . . 0.0 110.8 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.887 HD21 HD21 ' A' ' 74' ' ' LEU . 13.1 mt -66.36 -47.77 72.35 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.84 0.352 . . . . 0.0 111.083 177.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.709 ' HB3' HG21 ' A' ' 110' ' ' ILE . 0.6 OUTLIER -67.79 -26.17 65.96 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.966 0.413 . . . . 0.0 110.356 178.535 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -8.08 32.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.395 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -108.81 -12.03 14.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.576 0.226 . . . . 0.0 111.385 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.58 18.5 4.83 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.072 -1.061 . . . . 0.0 113.343 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.443 ' CE1' HD22 ' A' ' 102' ' ' LEU . 4.2 m-85 -66.2 140.16 58.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.307 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.563 ' HG3' ' HA ' ' A' ' 82' ' ' GLU . 14.5 mtpp -62.69 -84.69 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.194 -171.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.39 109.85 19.36 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.686 -177.169 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.709 HG21 ' HB3' ' A' ' 103' ' ' ARG . 1.3 tt -114.71 128.74 71.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.154 0.502 . . . . 0.0 111.247 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.607 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 12.0 m-85 -113.36 139.67 48.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.433 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -115.98 144.41 44.11 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.05 130.12 34.87 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.867 -173.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.801 ' HG2' ' HG3' ' A' ' 24' ' ' MET . 0.0 OUTLIER -96.09 17.29 15.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.374 172.777 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.46 -70.63 0.12 Allowed Glycine 0 N--CA 1.442 -0.944 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.836 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 114.59 177.71 18.96 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.08 179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' MET . . . . . 0.552 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -57.73 -37.98 74.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.822 0.344 . . . . 0.0 111.11 -178.199 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.53 -28.52 70.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.505 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -75.38 -31.95 60.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.37 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.69 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -57.24 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 62.4 mt -63.21 -37.4 87.08 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.555 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -60.23 -40.09 89.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.718 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.504 ' HB2' ' HG ' ' A' ' 125' ' ' LEU . 38.6 mm-40 -81.89 -3.08 53.3 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.251 -177.33 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.98 32.46 73.33 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.575 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 76.6 mt -78.82 163.26 61.58 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.359 -178.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.575 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 28.2 Cg_endo -57.53 113.26 1.42 Allowed 'Trans proline' 0 CA--C 1.517 -0.338 0 C-N-CA 122.824 2.35 . . . . 0.0 111.484 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.9 m -121.09 151.07 40.28 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LEU . . . . . 0.779 ' HB3' ' HE2' ' A' ' 56' ' ' LYS . 1.3 mt -98.92 101.35 12.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.838 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--N 1.316 -0.862 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.318 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 1.6 ttm . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 120.62 0.248 . . . . 0.0 111.316 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 4' ' ' GLY . . . . . 0.71 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -55.13 -34.96 59.02 Favored Glycine 0 C--O 1.227 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.427 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.58 -32.24 71.34 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 122.946 0.498 . . . . 0.0 111.628 176.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -72.79 -57.93 3.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.133 -174.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.71 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.3 p90 -74.75 -25.66 59.24 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.521 -176.417 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -53.71 -52.47 59.96 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 123.361 0.413 . . . . 0.0 110.553 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.81 -44.3 77.64 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.84 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -42.29 86.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -175.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 11' ' ' PHE . . . . . 0.403 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 0.6 OUTLIER -53.5 -43.81 68.54 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.221 0.534 . . . . 0.0 110.704 -178.699 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -24.58 65.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.258 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.66 -48.78 36.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.866 0.365 . . . . 0.0 110.81 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -67.69 -51.41 49.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.303 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.69 -34.1 41.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.935 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' LYS . . . . . 0.436 ' HE2' ' HB3' ' B' ' 16' ' ' LYS . 5.9 mtpt -66.63 -39.43 88.27 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.741 0.305 . . . . 0.0 111.16 176.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.93 -26.89 68.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.573 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.45 -33.3 64.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.116 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.658 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 0.1 OUTLIER -75.94 -21.25 57.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.125 0.488 . . . . 0.0 110.928 174.874 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.96 -19.16 61.94 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.026 -174.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.5 -1.18 57.62 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -176.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' MET . . . . . 0.856 ' HG3' HG23 ' B' ' 110' ' ' ILE . 1.5 mpp? -120.47 165.93 14.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.83 0.348 . . . . 0.0 111.343 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 15.4 t -80.99 103.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' MET . . . . . 0.658 ' SD ' ' HB3' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -79.14 107.21 11.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.997 0.427 . . . . 0.0 110.672 -174.912 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 25' ' ' LEU . . . . . 0.516 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.1 mt -126.73 142.08 51.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.662 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.48 151.8 85.33 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.203 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.428 ' HB2' ' CD1' ' B' ' 125' ' ' LEU . 4.7 Cg_endo -47.66 -31.33 14.14 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.854 3.036 . . . . 0.0 114.372 -177.176 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' LYS . . . . . 0.854 ' HD3' ' HG2' ' B' ' 123' ' ' GLU . 1.3 mtmm -74.43 -42.67 58.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.471 . . . . 0.0 110.791 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.94 -32.44 69.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.117 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.26 -44.05 69.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.464 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' TYR . . . . . 0.595 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.3 t80 -67.03 -30.47 70.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.204 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -57.09 -52.85 63.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.035 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.719 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -73.9 -27.75 61.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.677 178.321 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.695 HD11 ' HB2' ' B' ' 42' ' ' LEU . 1.1 mt -61.73 -55.8 26.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.945 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.06 -22.19 55.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.775 -173.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.84 -31.78 20.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.964 0.411 . . . . 0.0 110.555 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -121.3 102.94 42.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.437 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' PRO . . . . . 0.545 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 17.1 Cg_exo -68.27 5.81 1.08 Allowed 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.261 2.641 . . . . 0.0 112.545 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.83 -27.56 17.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.583 174.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.719 HD12 ' HB2' ' B' ' 33' ' ' LEU . 9.2 mt -82.37 109.2 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.688 175.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.417 HG21 ' HE2' ' B' ' 63' ' ' LYS . 1.2 m -100.25 145.22 28.35 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.672 -176.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.996 HD11 ' HB2' ' B' ' 88' ' ' PHE . 12.2 tp -101.1 122.58 43.84 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.302 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.479 HG23 ' HE3' ' B' ' 65' ' ' MET . 79.7 mt -103.85 111.16 32.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.213 176.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.833 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -98.96 129.43 45.27 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.68 96.64 4.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.366 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 46' ' ' ARG . . . . . 0.568 ' HG2' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -155.75 167.0 31.82 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.369 -177.464 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.47 ' H ' ' HD2' ' B' ' 46' ' ' ARG . 0.7 OUTLIER -75.6 125.66 88.31 Favored Pre-proline 0 C--N 1.314 -0.941 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.125 -176.439 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 48' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' B' ' 51' ' ' LEU . 18.4 Cg_endo -65.43 -19.79 61.22 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.901 2.401 . . . . 0.0 113.472 -172.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.66 -46.15 73.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.975 0.417 . . . . 0.0 110.472 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.05 -34.07 66.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.582 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.859 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.5 OUTLIER -58.87 -45.77 89.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.467 0.651 . . . . 0.0 110.253 176.597 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -66.53 -37.01 84.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.4 -48.41 10.38 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -174.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.1 -35.79 11.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.932 -172.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 135.64 159.36 8.53 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.125 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' LYS . . . . . 0.859 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -139.49 154.99 72.04 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.882 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.06 123.23 13.36 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.278 1.986 . . . . 0.0 112.562 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -101.83 74.99 1.51 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.2 0.524 . . . . 0.0 109.954 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.593 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.1 m -115.95 167.92 8.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.837 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -41.53 99.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.942 -175.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.545 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 0.0 OUTLIER -122.49 77.34 1.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.362 0.601 . . . . 0.0 110.857 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 62' ' ' TYR . . . . . 0.833 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.2 t80 -122.57 127.8 49.91 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.749 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.417 ' HE2' HG21 ' B' ' 41' ' ' THR . 11.2 mttt -123.29 124.57 43.27 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.876 176.002 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -88.11 128.34 35.42 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 65' ' ' MET . . . . . 0.479 ' HE3' HG23 ' B' ' 43' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.733 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 173.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.401 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.263 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.457 ' CB ' ' HD3' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -50.24 -59.47 7.06 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.399 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.594 ' HG3' ' HE2' ' A' ' 12' ' ' LYS . 3.9 Cg_exo -74.43 -15.85 22.04 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.605 2.203 . . . . 0.0 112.965 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 73' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' B' ' 73' ' ' LEU . 0.2 OUTLIER -87.19 -6.22 58.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.607 0.242 . . . . 0.0 111.504 -174.767 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.598 HD23 ' CD1' ' A' ' 7' ' ' PHE . 6.0 tp -63.98 -54.87 27.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.555 -175.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.627 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -69.73 -23.62 63.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.891 0.377 . . . . 0.0 111.399 -179.439 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.91 -31.21 61.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.796 -177.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -73.93 -39.26 63.92 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.13 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.55 81.2 1.46 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.908 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.5 mt -123.45 142.54 50.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.657 0.265 . . . . 0.0 110.93 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 80' ' ' ASP . . . . . 0.514 ' OD2' ' HG2' ' B' ' 83' ' ' LYS . 0.0 OUTLIER -114.77 136.28 22.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.24 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.49 -0.37 2.93 Favored 'Trans proline' 0 N--CA 1.476 0.468 0 C-N-CA 123.078 2.519 . . . . 0.0 114.234 -172.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.444 ' HB2' ' OD2' ' B' ' 80' ' ' ASP . 3.6 mm-40 -98.73 -11.59 21.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 0.0 110.717 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' LYS . . . . . 0.514 ' HG2' ' OD2' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -82.85 122.01 77.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.626 179.028 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.547 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 15.9 Cg_exo -63.94 132.7 35.6 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.363 2.042 . . . . 0.0 110.168 173.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.516 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.0 OUTLIER -131.58 143.01 41.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 120.893 0.378 . . . . 0.0 111.124 -173.414 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.538 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 0.7 OUTLIER -121.85 139.78 47.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 175.508 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 87' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' B' ' 43' ' ' ILE . 1.3 m -102.8 126.46 57.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.074 0.464 . . . . 0.0 110.33 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 88' ' ' PHE . . . . . 0.996 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.2 t80 -111.88 140.27 46.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.371 -174.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 89' ' ' CYS . . . . . 0.568 ' SG ' ' HG2' ' B' ' 46' ' ' ARG . 49.6 t . . . . . 0 N--CA 1.463 0.189 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.866 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.934 0.397 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.36 72.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.111 -176.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 97' ' ' LEU . . . . . 0.453 HD21 HD21 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -67.78 -39.59 84.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.799 0.333 . . . . 0.0 110.93 -178.461 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.99 -45.57 70.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.0 0.429 . . . . 0.0 110.237 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.21 -50.47 33.17 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.54 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 100' ' ' LYS . . . . . 0.596 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -60.96 -38.35 85.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -173.943 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 101' ' ' THR . . . . . 0.596 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 2.3 m -72.84 -35.91 67.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.614 0.245 . . . . 0.0 111.06 178.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 10.1 mt -62.94 -47.82 81.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.515 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 103' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -65.09 -26.75 68.36 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.906 0.384 . . . . 0.0 110.53 179.209 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -69.36 -7.45 37.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.828 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 105' ' ' TYR . . . . . 0.412 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 23.5 m-85 -103.36 -8.24 20.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 0.0 110.938 178.281 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.14 41.4 1.53 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.243 -0.979 . . . . 0.0 112.735 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -87.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.418 -175.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.17 119.62 35.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.879 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 110' ' ' ILE . . . . . 0.856 HG23 ' HG3' ' B' ' 22' ' ' MET . 1.2 tt -119.46 126.58 75.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.252 0.549 . . . . 0.0 110.818 -176.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 111' ' ' TYR . . . . . 0.538 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 3.1 m-85 -112.95 141.67 46.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.866 -174.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.421 ' HB3' ' CE ' ' B' ' 24' ' ' MET . 0.7 OUTLIER -112.26 139.51 47.74 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.301 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 113' ' ' SER . . . . . 0.516 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 0.3 OUTLIER -81.93 119.86 24.48 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -173.266 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 114' ' ' GLU . . . . . 0.562 ' CG ' ' HB3' ' B' ' 24' ' ' MET . 2.4 mm-40 -82.08 5.19 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.79 177.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -107.99 -99.06 2.59 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.012 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 155.18 166.74 15.82 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 117' ' ' MET . . . . . 0.469 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.1 OUTLIER -59.75 -39.19 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.006 0.431 . . . . 0.0 110.75 -178.208 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 118' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 18.6 p-10 -68.78 -23.85 64.35 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.83 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 119' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' B' ' 119' ' ' LYS . 0.1 OUTLIER -73.67 -32.14 63.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.883 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 120' ' ' TRP . . . . . 0.683 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 27.7 t-105 -58.83 -51.46 69.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.736 177.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 11.5 mt -67.3 -40.12 86.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.144 178.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 122' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.2 OUTLIER -63.7 -45.93 87.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.665 -176.706 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 123' ' ' GLU . . . . . 0.854 ' HG2' ' HD3' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -83.69 17.05 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.646 -176.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 67.44 23.05 73.46 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.007 171.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.668 HD12 ' HA ' ' B' ' 120' ' ' TRP . 53.3 mt -75.29 154.54 86.15 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 117.101 0.451 . . . . 0.0 110.347 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -58.65 115.75 2.77 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.046 2.497 . . . . 0.0 112.219 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.17 150.59 52.0 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.181 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 128' ' ' LEU . . . . . 0.472 ' HB2' ' HG2' ' B' ' 56' ' ' LYS . 2.5 mt . . . . . 0 N--CA 1.445 -0.676 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.544 ' HG3' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 120.767 0.318 . . . . 0.0 110.331 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.549 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -62.69 -39.8 98.38 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.783 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -65.03 -32.88 74.82 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.266 0.555 . . . . 0.0 110.289 176.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . 0.544 ' HG3' ' HG3' ' A' ' 3' ' ' MET . 17.0 mmtt -64.78 -57.5 8.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 112.252 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.549 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.8 p90 -80.43 -26.65 38.29 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 119.788 -0.765 . . . . 0.0 112.065 -174.445 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . 0.449 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . 16.0 t70 -53.85 -51.18 64.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.959 0.409 . . . . 0.0 111.176 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.388 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -68.57 -40.62 80.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.932 -175.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.427 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.5 OUTLIER -57.86 -45.96 85.54 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.194 0.521 . . . . 0.0 110.293 -178.402 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.56 ' HD3' ' HG3' ' B' ' 72' ' ' PRO . 1.2 tptp -65.31 -24.98 67.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.083 175.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.18 -44.54 46.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.227 178.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -71.51 -51.3 24.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.613 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.24 -33.63 43.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.979 0.419 . . . . 0.0 110.869 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -37.4 70.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.356 177.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.35 -26.04 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.028 0.442 . . . . 0.0 111.551 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.04 -31.63 66.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.06 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -76.14 -22.43 55.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.42 0.628 . . . . 0.0 110.579 173.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.15 58.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.865 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -76.85 -9.12 58.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.886 -176.6 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -127.98 171.6 11.69 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.128 -0.357 . . . . 0.0 111.299 -177.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -84.49 109.66 18.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' MET . . . . . 0.721 ' SD ' ' HB3' ' A' ' 112' ' ' ASN . 0.6 OUTLIER -78.02 103.47 7.98 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.7 -174.739 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.596 ' O ' ' HA ' ' A' ' 113' ' ' SER . 7.5 mt -121.1 140.89 51.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.157 0.503 . . . . 0.0 111.316 -177.165 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 141.77 76.15 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.052 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -44.51 -30.12 3.7 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 124.203 3.269 . . . . 0.0 114.636 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.457 ' HG2' ' OE2' ' A' ' 123' ' ' GLU . 0.4 OUTLIER -73.65 -42.59 61.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.941 0.4 . . . . 0.0 111.142 178.477 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.38 -33.25 69.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.212 177.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.428 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -65.98 -47.46 74.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.082 176.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TYR . . . . . 0.617 ' HA ' HD12 ' A' ' 34' ' ' LEU . 51.6 t80 -64.2 -30.53 71.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.076 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -52.61 64.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.022 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.423 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -73.73 -27.42 61.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.886 178.758 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 31' ' ' TYR . 35.2 mt -62.32 -54.65 37.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.302 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLN . . . . . 0.448 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -76.39 -28.03 56.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.04 -174.348 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.448 ' N ' ' HG3' ' A' ' 35' ' ' GLN . 17.7 mt-10 -79.74 -34.13 40.23 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.222 0.534 . . . . 0.0 110.426 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -117.53 94.58 45.92 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.718 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -60.87 -2.83 2.36 Favored 'Trans proline' 0 N--CA 1.474 0.381 0 C-N-CA 123.201 2.6 . . . . 0.0 113.921 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -96.98 -18.92 19.13 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.955 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.502 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 23.5 mt -77.25 108.59 10.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.487 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -100.33 145.2 28.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.515 -173.979 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.744 HD11 ' HB2' ' A' ' 88' ' ' PHE . 7.8 tp -103.85 129.2 51.29 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.3 mp -112.7 121.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.091 0.472 . . . . 0.0 109.876 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.822 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -98.38 138.87 34.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.844 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.97 95.33 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.489 0.662 . . . . 0.0 109.462 174.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.602 ' HB3' HD13 ' A' ' 51' ' ' LEU . 1.8 tpt85 -152.24 163.85 38.57 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.274 -0.876 . . . . 0.0 108.774 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.49 139.92 31.81 Favored Pre-proline 0 C--N 1.322 -0.61 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.15 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -62.09 -19.32 65.97 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.322 2.681 . . . . 0.0 115.059 -166.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.461 ' HB2' ' OE2' ' B' ' 50' ' ' GLU . 0.1 OUTLIER -76.7 -39.2 52.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.041 -0.664 . . . . 0.0 111.386 -178.927 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.19 -37.55 66.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.602 HD13 ' HB3' ' A' ' 46' ' ' ARG . 0.8 OUTLIER -59.34 -45.84 90.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.234 0.54 . . . . 0.0 110.912 177.327 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -35.52 80.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.85 -177.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.87 -48.52 12.26 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -175.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -92.62 -36.79 12.79 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.578 -0.449 . . . . 0.0 112.199 -173.07 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.3 173.19 13.51 Favored Glycine 0 N--CA 1.44 -1.097 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.819 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LYS . . . . . 0.566 ' HB2' ' HD2' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -149.04 165.7 17.09 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.729 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.566 ' HD2' ' HB2' ' A' ' 56' ' ' LYS . 18.6 Cg_endo -63.78 123.63 12.3 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 121.881 1.72 . . . . 0.0 112.387 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -94.16 71.97 3.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.072 0.463 . . . . 0.0 110.044 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.5 m -115.94 174.41 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.34 -24.27 32.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.812 0.339 . . . . 0.0 111.383 -176.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -125.43 66.45 1.15 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.384 0.612 . . . . 0.0 111.335 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' TYR . . . . . 0.822 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 0.8 OUTLIER -132.84 139.13 47.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.623 177.332 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.487 ' HE2' HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -135.36 135.72 40.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.975 0.417 . . . . 0.0 110.533 176.399 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.0 t-160 -93.18 115.63 28.25 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.493 178.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.403 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 178.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.487 ' HG ' ' N ' ' A' ' 71' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.962 ' HB3' ' HB3' ' B' ' 11' ' ' PHE . 0.0 OUTLIER -45.01 -57.62 6.85 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.757 -174.603 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.519 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 74.0 Cg_endo -73.65 -15.87 24.14 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.051 1.834 . . . . 0.0 112.605 178.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.467 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -81.29 -22.32 38.68 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.283 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.685 HD21 HD21 ' A' ' 102' ' ' LEU . 3.7 tp -58.31 -53.16 61.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.137 177.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.01 -27.38 68.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.585 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.91 -22.54 39.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.755 0.312 . . . . 0.0 111.235 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' SER . . . . . 0.465 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 49.8 m -79.57 -35.82 39.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.9 -177.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.18 63.39 1.04 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.521 -0.847 . . . . 0.0 111.869 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.7 mt -110.45 136.67 49.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.574 0.226 . . . . 0.0 110.408 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASP . . . . . 0.503 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -121.52 138.81 28.81 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.238 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PRO . . . . . 0.43 ' HG3' ' SD ' ' B' ' 3' ' ' MET . 31.9 Cg_endo -68.56 8.01 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.903 2.402 . . . . 0.0 113.719 -174.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -102.27 -17.44 15.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 122.106 -0.371 . . . . 0.0 110.616 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.503 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -93.69 126.19 50.64 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.684 178.499 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.621 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 18.1 Cg_exo -65.36 143.75 77.68 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.769 2.313 . . . . 0.0 111.362 177.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.509 HG23 HD12 ' A' ' 110' ' ' ILE . 2.4 m -137.72 149.65 25.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.076 0.465 . . . . 0.0 111.046 -178.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.564 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 0.7 OUTLIER -125.74 142.91 41.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.488 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.447 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 2.9 m -103.4 134.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.951 0.405 . . . . 0.0 110.608 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' PHE . . . . . 0.744 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -120.12 141.47 49.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.939 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 46.8 t . . . . . 0 C--O 1.235 0.309 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.887 177.696 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.447 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.464 0.257 0 CA-C-O 120.971 0.415 . . . . 0.0 111.299 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -28.56 69.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.287 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.74 -38.89 92.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.695 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.9 -46.76 33.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.693 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -65.46 -55.48 20.47 Favored Glycine 0 CA--C 1.519 0.299 0 C-N-CA 121.058 -0.591 . . . . 0.0 113.57 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LYS . . . . . 0.551 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -61.86 -32.86 73.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.813 0.34 . . . . 0.0 111.199 -174.993 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 101' ' ' THR . . . . . 0.479 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 44.1 m -72.88 -38.74 66.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.782 0.325 . . . . 0.0 110.974 177.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . 0.685 HD21 HD21 ' A' ' 74' ' ' LEU . 11.6 mt -64.3 -45.2 89.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.47 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.1 -27.47 68.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.919 0.39 . . . . 0.0 110.597 179.157 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.19 -6.73 41.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.368 178.009 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' TYR . . . . . 0.454 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 22.6 m-85 -104.21 -5.42 21.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.784 0.326 . . . . 0.0 110.543 176.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 107.07 34.61 2.93 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.952 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -78.23 139.27 38.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.682 0.277 . . . . 0.0 110.44 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -60.85 3.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.751 -172.248 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.621 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -139.23 120.01 14.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.294 -178.573 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ILE . . . . . 0.546 HG21 ' HB3' ' A' ' 103' ' ' ARG . 0.7 OUTLIER -121.37 127.16 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.23 0.538 . . . . 0.0 111.397 -176.712 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.564 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 1.9 m-85 -118.52 145.76 45.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.261 -176.118 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ASN . . . . . 0.721 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 38.4 t-20 -117.12 143.41 45.84 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . 0.596 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -97.23 115.46 27.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -172.851 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLU . . . . . 0.471 ' HG3' ' HB3' ' A' ' 24' ' ' MET . 2.9 mm-40 -76.32 33.96 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -139.84 -78.44 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.315 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 114.02 178.8 19.14 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.548 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' MET . . . . . 0.432 ' SD ' ' HD3' ' A' ' 57' ' ' PRO . 10.4 tpp -53.61 -38.49 64.07 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.017 0.437 . . . . 0.0 111.178 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -58.48 -41.66 85.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.573 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.8 -32.66 63.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.355 179.598 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.612 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -61.11 -53.66 54.26 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 9.1 mt -63.68 -42.19 98.06 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.109 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.41 -41.49 93.53 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.804 -177.462 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLU . . . . . 0.564 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -67.08 -21.2 65.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.913 0.387 . . . . 0.0 110.972 -177.343 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 90.5 21.87 36.14 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.883 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.564 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 24.3 mt -75.97 159.53 80.54 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 177.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.493 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 14.4 Cg_endo -54.17 114.03 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.973 2.449 . . . . 0.0 111.704 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.05 148.78 41.93 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 120.991 0.424 . . . . 0.0 110.698 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.5 mt -97.02 100.77 12.26 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.312 -1.038 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -175.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' MET . . . . . 0.437 ' HG2' ' HG3' ' B' ' 6' ' ' LYS . 14.1 mtp . . . . . 0 C--O 1.233 0.201 0 CA-C-O 120.654 0.264 . . . . 0.0 111.374 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 4' ' ' GLY . . . . . 0.596 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.49 -35.03 78.04 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.319 -0.467 . . . . 0.0 113.434 -177.625 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.83 -31.88 66.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.012 0.434 . . . . 0.0 110.561 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LYS . . . . . 0.503 ' HD3' ' HA ' ' B' ' 6' ' ' LYS . 6.2 mmtt -71.31 -57.8 4.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.134 -173.229 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.596 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.6 p90 -73.01 -35.59 66.84 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.103 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.33 -56.08 22.1 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.83 0.348 . . . . 0.0 110.877 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.08 -46.55 85.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.801 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.53 -41.87 92.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.536 -177.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' PHE . . . . . 0.962 ' HB3' ' HB3' ' A' ' 71' ' ' GLU . 0.3 OUTLIER -54.11 -43.89 70.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.217 0.532 . . . . 0.0 110.525 -178.045 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -65.24 -24.43 67.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.619 177.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.41 -49.78 21.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.38 . . . . 0.0 110.853 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' GLN . . . . . 0.405 ' OE1' HG23 ' A' ' 101' ' ' THR . 65.2 mt-30 -71.33 -52.0 21.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.896 -178.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.411 ' HB ' ' O ' ' B' ' 11' ' ' PHE . 0.8 OUTLIER -56.29 -33.47 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.146 -177.551 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -70.94 -34.92 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.2 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -26.74 68.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.934 0.397 . . . . 0.0 111.065 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.17 72.03 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.631 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' LYS . . . . . 0.532 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 6.9 mtmt -76.07 -22.38 55.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.351 0.596 . . . . 0.0 111.008 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.28 -19.02 61.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.122 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.62 -5.46 56.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.527 -177.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' MET . . . . . 0.924 ' HG3' HG23 ' B' ' 110' ' ' ILE . 1.5 mpp? -122.16 176.33 5.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.567 0.222 . . . . 0.0 110.79 -179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 31.5 t -88.37 105.03 15.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' MET . . . . . 0.532 ' SD ' ' HB3' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -75.68 111.28 10.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.998 0.428 . . . . 0.0 110.767 -175.223 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 25' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' B' ' 25' ' ' LEU . 5.2 mt -124.17 144.29 50.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.081 -176.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.15 146.04 61.97 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.547 176.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -51.52 -21.56 10.84 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.522 2.815 . . . . 0.0 114.104 -175.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -75.03 -47.45 28.95 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.053 0.454 . . . . 0.0 110.821 175.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.02 -32.63 72.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.82 -47.79 61.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.967 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 31' ' ' TYR . . . . . 0.512 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 86.2 t80 -67.02 -29.73 69.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.748 178.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.96 -53.51 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.82 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -74.08 -27.59 60.97 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.01 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.607 HD11 ' HB2' ' B' ' 42' ' ' LEU . 0.2 OUTLIER -62.53 -45.84 91.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.136 178.454 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -75.87 -26.99 57.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.487 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 -29.43 26.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.813 0.339 . . . . 0.0 110.771 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -125.68 98.73 33.77 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.268 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.64 2.74 1.8 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.13 2.554 . . . . 0.0 112.871 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -90.33 -20.77 22.51 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ILE . . . . . 0.582 HG12 ' HB2' ' B' ' 84' ' ' PRO . 41.1 mt -80.22 112.52 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.123 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' THR . . . . . 0.561 ' HB ' HG12 ' B' ' 85' ' ' VAL . 1.9 m -94.72 140.64 29.62 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.057 -178.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.845 HD11 ' HB2' ' B' ' 88' ' ' PHE . 8.0 tp -105.12 123.82 48.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 43' ' ' ILE . . . . . 0.417 ' HA ' ' O ' ' B' ' 63' ' ' LYS . 2.1 mp -110.29 115.53 49.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.573 177.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 44' ' ' ASP . . . . . 0.809 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.3 OUTLIER -99.06 140.51 33.11 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.553 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.87 94.7 2.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.655 0.741 . . . . 0.0 109.84 174.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' ARG . . . . . 0.654 ' HD3' ' SD ' ' B' ' 117' ' ' MET . 21.0 mtp85 -145.44 164.18 32.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.362 178.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -73.28 134.25 80.27 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.242 -173.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -65.05 -21.39 63.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.449 2.766 . . . . 0.0 114.621 -169.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.35 -31.31 48.5 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.251 -0.579 . . . . 0.0 110.268 177.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 50' ' ' GLU . . . . . 0.461 ' OE2' ' HB2' ' A' ' 49' ' ' ASP . 2.3 mm-40 -70.91 -40.88 71.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.046 173.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.778 HD23 ' HD3' ' B' ' 56' ' ' LYS . 0.5 OUTLIER -60.2 -33.57 72.42 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.605 176.975 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -39.12 54.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.512 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.47 -46.83 13.98 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 4.1 mtm -97.65 -35.06 10.71 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.716 -0.393 . . . . 0.0 111.5 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.42 173.17 14.2 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.262 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' LYS . . . . . 0.778 ' HD3' HD23 ' B' ' 51' ' ' LEU . 0.0 OUTLIER -138.82 156.73 72.65 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.401 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 57' ' ' PRO . . . . . 0.487 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 16.4 Cg_endo -60.8 125.21 16.64 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.647 2.231 . . . . 0.0 112.956 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' ASP . . . . . 0.791 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 17.7 t0 -97.5 96.3 8.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.236 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 59' ' ' VAL . . . . . 0.684 HG22 ' HB2' ' B' ' 62' ' ' TYR . 34.9 m -130.89 164.65 33.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.302 176.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -38.95 77.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.564 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -124.6 75.89 1.45 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.14 0.495 . . . . 0.0 110.851 -177.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 62' ' ' TYR . . . . . 0.809 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 13.5 t80 -118.08 126.02 51.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.451 -178.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 63' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 43' ' ' ILE . 15.4 mttm -128.04 120.48 27.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.964 0.412 . . . . 0.0 110.346 178.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 64' ' ' HIS . . . . . 0.481 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 11.5 t-160 -95.83 114.2 25.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' MET . . . . . 0.443 ' SD ' ' HA ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.614 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 177.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' LEU . . . . . 0.53 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.514 -0.407 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 71' ' ' GLU . . . . . 0.53 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.3 -60.32 4.21 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.295 -175.908 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 72' ' ' PRO . . . . . 0.56 ' HG3' ' HD3' ' A' ' 12' ' ' LYS . 3.5 Cg_exo -74.66 -16.36 21.16 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.692 2.261 . . . . 0.0 112.916 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -91.11 -21.74 21.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.678 0.275 . . . . 0.0 111.458 -174.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' LEU . . . . . 0.711 HD21 HD21 ' B' ' 102' ' ' LEU . 3.4 tp -61.02 -51.27 69.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.607 -173.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 75' ' ' ALA . . . . . 0.449 ' CB ' ' HB2' ' A' ' 8' ' ' ASP . . . -74.1 -17.49 60.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -76.15 -24.7 54.84 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -176.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.64 -28.0 51.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.8 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.67 83.41 1.56 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.303 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.0 mt -126.0 144.68 50.61 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.199 -0.296 . . . . 0.0 110.199 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -114.11 130.51 23.85 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 81' ' ' PRO . . . . . 0.651 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 33.8 Cg_endo -68.47 -6.81 18.55 Favored 'Trans proline' 0 N--CA 1.472 0.255 0 C-N-CA 122.921 2.414 . . . . 0.0 113.912 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -98.95 2.58 46.57 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.42 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 83' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' B' ' 83' ' ' LYS . 33.3 mmtm -106.76 142.66 25.44 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.132 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 84' ' ' PRO . . . . . 0.582 ' HB2' HG12 ' B' ' 40' ' ' ILE . 16.9 Cg_exo -69.35 134.71 29.53 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.545 2.163 . . . . 0.0 111.859 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 85' ' ' VAL . . . . . 0.561 HG12 ' HB ' ' B' ' 41' ' ' THR . 5.6 m -135.65 147.91 28.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.39 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 86' ' ' VAL . . . . . 0.557 HG13 HD12 ' B' ' 42' ' ' LEU . 0.5 OUTLIER -126.5 141.42 46.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.784 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 m -103.28 122.1 55.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.057 0.456 . . . . 0.0 110.062 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' PHE . . . . . 0.845 ' HB2' HD11 ' B' ' 42' ' ' LEU . 7.3 t80 -110.28 143.87 39.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.702 -175.253 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 53.4 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.92 177.111 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.932 0.396 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 96' ' ' ALA . . . . . 0.408 ' N ' HD21 ' B' ' 112' ' ' ASN . . . -60.97 -28.99 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.513 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -40.4 90.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.965 0.412 . . . . 0.0 110.502 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 98' ' ' ALA . . . . . 0.427 ' HA ' ' HZ ' ' A' ' 11' ' ' PHE . . . -70.37 -40.42 74.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.72 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 99' ' ' GLY . . . . . 0.448 ' HA2' HD11 ' B' ' 110' ' ' ILE . . . -76.92 -49.87 7.36 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.799 -0.715 . . . . 0.0 113.615 -176.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 100' ' ' LYS . . . . . 0.601 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -64.79 -30.14 71.14 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.558 -0.378 . . . . 0.0 111.873 -172.238 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 3.2 m -72.03 -35.9 69.52 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.12 0.486 . . . . 0.0 110.163 175.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 102' ' ' LEU . . . . . 0.711 HD21 HD21 ' B' ' 74' ' ' LEU . 9.2 mt -67.1 -42.69 84.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.736 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 103' ' ' ARG . . . . . 0.601 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -62.25 -27.28 68.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.986 0.422 . . . . 0.0 110.497 179.799 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -6.75 42.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.736 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -104.38 -7.99 19.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.836 0.351 . . . . 0.0 110.634 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 111.52 15.28 10.49 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.655 175.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 107' ' ' PHE . . . . . 0.651 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 6.7 m-85 -61.88 125.79 25.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.793 0.33 . . . . 0.0 110.495 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -76.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.077 -172.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 109' ' ' THR . . . . . 0.553 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -117.33 104.4 11.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.523 -174.172 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 110' ' ' ILE . . . . . 0.924 HG23 ' HG3' ' B' ' 22' ' ' MET . 1.5 tt -114.97 125.75 72.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.164 0.507 . . . . 0.0 110.967 -176.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 111' ' ' TYR . . . . . 0.465 ' CD1' ' HB ' ' B' ' 86' ' ' VAL . 1.1 m-85 -115.3 143.79 44.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.776 -175.059 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 112' ' ' ASN . . . . . 0.408 HD21 ' N ' ' B' ' 96' ' ' ALA . 0.7 OUTLIER -114.28 143.34 45.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.56 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 88.7 p -79.74 129.09 34.18 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.839 0.352 . . . . 0.0 111.53 -172.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -97.61 8.18 45.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.082 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -122.3 -96.16 1.33 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.741 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 156.64 172.81 24.37 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.007 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 117' ' ' MET . . . . . 0.654 ' SD ' ' HD3' ' B' ' 46' ' ' ARG . 36.1 ttm -62.25 -35.38 78.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.08 0.467 . . . . 0.0 110.22 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -33.56 74.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.194 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.01 -33.81 66.0 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.035 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 120' ' ' TRP . . . . . 0.65 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.6 t-105 -58.68 -51.9 67.97 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 18.7 mt -62.93 -40.01 96.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.992 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.71 -43.33 80.3 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.335 -175.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.4 0.87 10.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.663 0.268 . . . . 0.0 111.244 -176.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 76.74 24.43 67.29 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.043 -0.598 . . . . 0.0 112.337 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 125' ' ' LEU . . . . . 0.524 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 77.6 mt -77.39 161.29 73.06 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 126' ' ' PRO . . . . . 0.524 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 38.2 Cg_endo -66.86 129.86 21.82 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.781 2.321 . . . . 0.0 112.29 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.74 148.73 52.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.814 0.34 . . . . 0.0 110.773 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 128' ' ' LEU . . . . . 0.791 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.7 mt . . . . . 0 C--N 1.325 -0.465 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.112 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -167.72 42.62 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.741 -171.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.559 ' SD ' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -80.34 19.36 0.78 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.03 -176.304 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.653 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -58.95 -38.32 92.55 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.961 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -71.42 -38.67 71.39 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.985 0.421 . . . . 0.0 110.488 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.559 ' HG3' ' SD ' ' A' ' 3' ' ' MET . 7.7 mmtt -60.54 -56.37 22.2 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.534 -176.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.653 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 1.1 p90 -76.46 -21.96 55.19 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 119.89 -0.724 . . . . 0.0 111.793 -175.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.713 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 0.0 OUTLIER -52.45 -46.11 66.34 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 123.447 0.467 . . . . 0.0 111.013 -178.103 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.43 -42.03 81.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.342 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.489 ' HB ' ' CE1' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -67.61 -43.13 81.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.287 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.503 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.6 OUTLIER -57.69 -44.45 85.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.301 179.282 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.661 ' HD2' ' HG3' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -66.46 -26.52 67.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.373 178.117 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.86 -42.37 63.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.078 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.0 -51.03 23.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.173 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.77 -38.37 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.237 -173.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.661 ' HG3' ' HD2' ' A' ' 12' ' ' LYS . 0.9 OUTLIER -69.55 -32.62 71.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 0.0 111.368 -177.808 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.24 -26.12 66.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.384 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.38 -36.11 80.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.136 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.03 -22.28 49.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.288 0.566 . . . . 0.0 110.962 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.43 -19.13 50.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.544 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.78 -33.81 75.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.12 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.684 ' HB3' ' HD3' ' A' ' 103' ' ' ARG . 8.6 ptm -116.99 -172.61 2.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.211 0.529 . . . . 0.0 112.274 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.6 t -79.84 112.96 18.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.272 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 120.97 29.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.019 0.437 . . . . 0.0 110.491 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 25' ' ' LEU . 2.3 mt -118.2 -168.47 1.53 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.902 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -126.61 144.13 48.7 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 173.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.423 ' HB2' ' CD1' ' A' ' 125' ' ' LEU . 1.2 Cg_endo -46.77 -30.37 9.19 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 123.933 3.089 . . . . 0.0 114.209 -174.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm -75.02 -43.8 51.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.943 0.401 . . . . 0.0 110.792 176.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.2 -32.24 73.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.393 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.639 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.01 -47.97 40.42 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.78 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.708 ' HA ' HD12 ' A' ' 34' ' ' LEU . 83.9 t80 -62.97 -33.41 75.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.862 178.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -53.9 -52.57 60.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.187 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.502 HD13 HG21 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -74.05 -26.18 60.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.364 179.756 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.708 HD12 ' HA ' ' A' ' 31' ' ' TYR . 99.0 mt -65.64 -48.77 71.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 111.275 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -75.69 -28.55 58.69 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.707 -174.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -86.59 -37.02 18.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.11 0.481 . . . . 0.0 110.511 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -116.48 97.43 50.0 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.77 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.566 ' HA ' ' ND2' ' A' ' 61' ' ' ASN . 35.7 Cg_endo -67.02 3.73 1.45 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 122.912 2.408 . . . . 0.0 112.902 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -91.38 -27.94 18.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.015 0.436 . . . . 0.0 110.24 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.508 HG12 ' HG2' ' A' ' 84' ' ' PRO . 25.0 mt -81.88 109.74 16.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.817 175.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.675 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -99.08 145.65 26.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.697 -175.16 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.651 HD11 ' HB2' ' A' ' 88' ' ' PHE . 2.7 tp -101.44 133.26 46.34 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.6 mt -112.77 117.1 54.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.529 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.856 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.1 OUTLIER -99.21 138.38 36.4 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.666 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.17 98.73 5.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.534 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.797 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -156.76 162.89 39.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.445 178.551 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.797 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 3.4 m-20 -80.68 157.97 71.45 Favored Pre-proline 0 C--N 1.318 -0.777 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.162 -174.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 36.6 Cg_endo -72.1 -23.1 21.83 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.859 2.373 . . . . 0.0 114.758 -170.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.454 ' HB2' ' HG3' ' B' ' 50' ' ' GLU . 3.7 t70 -78.14 -37.86 45.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.704 -0.798 . . . . 0.0 111.763 -177.002 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 46' ' ' ARG . 1.4 tt0 -70.53 -39.28 74.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.749 175.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.845 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 mp -59.56 -34.8 73.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.293 177.059 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -78.94 -45.13 21.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.164 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.54 -47.97 13.43 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 6.4 mmm -98.63 -36.25 9.94 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.629 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 173.3 14.15 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.536 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.845 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -143.64 162.28 42.42 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.199 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.46 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.5 Cg_endo -59.53 133.34 51.2 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.391 2.061 . . . . 0.0 113.156 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -95.9 95.36 8.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.063 174.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 1.048 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -129.88 145.08 36.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.289 -178.377 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.84 95.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.308 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.675 ' HB2' HG23 ' A' ' 41' ' ' THR . 0.8 OUTLIER -110.89 76.8 1.0 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.255 -178.566 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 1.048 ' HB2' HG23 ' A' ' 59' ' ' VAL . 4.9 t80 -120.34 125.92 49.22 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.162 -171.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.461 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 2.6 mtmt -122.88 113.12 18.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 174.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 62' ' ' TYR . 11.5 t-160 -92.39 113.08 25.25 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.993 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -114.01 103.31 11.02 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.744 -174.84 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.438 ' HB2' ' H ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -91.96 -105.09 0.11 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -174.145 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.619 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER 57.1 -131.64 1.51 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 -171.624 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.612 ' O ' ' HA ' ' B' ' 92' ' ' ALA . . . -95.25 -45.33 3.05 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 119.449 -1.358 . . . . 0.0 110.754 174.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.99 ' HE3' ' HA ' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -152.05 43.09 0.7 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.742 -0.229 . . . . 0.0 110.81 173.097 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 70.54 -2.52 2.18 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.06 -0.973 . . . . 0.0 113.13 173.594 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.634 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.2 OUTLIER -45.88 -63.94 1.1 Allowed Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.622 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.634 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 7.7 Cg_exo -74.49 -16.11 21.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.4 2.066 . . . . 0.0 113.159 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.801 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.8 OUTLIER -90.71 -15.66 29.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.33 -175.255 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.681 HD13 HD11 ' A' ' 70' ' ' LEU . 42.8 tp -57.13 -53.28 59.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.3 0.571 . . . . 0.0 110.729 -178.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.439 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -69.39 -22.6 63.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.357 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 4.3 mttm -73.8 -30.12 62.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.765 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.461 ' HB2' ' HD2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -78.18 -37.36 45.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.94 0.4 . . . . 0.0 110.449 -178.929 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.98 86.8 1.97 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.627 -176.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.48 145.12 51.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.872 0.368 . . . . 0.0 111.097 -177.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.41 ' OD1' ' HD2' ' A' ' 81' ' ' PRO . 3.1 t0 -129.15 146.58 61.39 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 40.9 Cg_endo -69.77 9.19 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.987 2.458 . . . . 0.0 113.872 -175.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.49 18.61 15.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.322 0.582 . . . . 0.0 110.004 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -111.63 127.37 26.98 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.442 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.508 ' HG2' HG12 ' A' ' 40' ' ' ILE . 5.9 Cg_exo -75.57 129.35 11.76 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.426 2.084 . . . . 0.0 111.172 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.502 HG23 HD12 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -139.11 151.04 23.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.053 -177.183 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.8 p -127.32 144.83 36.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.558 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 8.2 m -112.15 142.24 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.734 0.302 . . . . 0.0 110.725 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.769 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.0 OUTLIER -108.69 158.2 17.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.495 -178.667 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' CYS . . . . . 0.667 ' HB3' ' HB3' ' A' ' 93' ' ' ALA . 1.0 OUTLIER 67.47 62.75 0.44 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.417 0.627 . . . . 0.0 111.481 179.563 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.666 ' HA ' ' HB3' ' A' ' 95' ' ' ALA . 0.3 OUTLIER -62.35 -49.37 75.87 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -174.78 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.467 ' HB ' ' S5 ' ' A' ' 138' ' ' PS5 . 0.0 OUTLIER -76.5 -86.08 0.05 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -168.022 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.71 -56.84 15.76 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -172.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.667 ' HB3' ' HB3' ' A' ' 89' ' ' CYS . . . -64.82 -26.92 68.55 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.436 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER 74.87 58.45 0.07 Allowed 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.541 178.423 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.666 ' HB3' ' HA ' ' A' ' 90' ' ' LYS . . . -64.01 -20.86 66.21 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 109.908 172.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -33.49 70.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.712 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -74.23 -30.39 62.15 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.34 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.84 -40.73 54.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.745 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.47 -46.12 3.31 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.518 -0.849 . . . . 0.0 113.598 -172.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.41 -24.24 67.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.705 0.288 . . . . 0.0 111.227 -174.29 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.43 -49.65 66.01 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.442 175.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 74' ' ' LEU . 39.4 mt -58.48 -41.95 86.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.446 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.684 ' HD3' ' HB3' ' A' ' 22' ' ' MET . 0.0 OUTLIER -71.53 -27.12 62.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 0.0 110.578 177.356 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.38 -9.35 58.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.705 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.483 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 19.4 m-85 -100.24 -40.86 7.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 144.56 41.13 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.259 175.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.438 ' CE1' HD22 ' A' ' 102' ' ' LEU . 4.0 m-85 -88.05 138.76 31.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.931 0.366 . . . . 0.0 110.367 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -61.32 -72.83 0.11 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.874 -174.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.86 107.44 10.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.064 0.459 . . . . 0.0 111.247 -176.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.502 HD12 HG23 ' A' ' 85' ' ' VAL . 1.2 tt -117.61 132.73 66.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.566 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -115.0 146.09 41.59 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.578 -177.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.439 ' OD1' ' HB3' ' A' ' 90' ' ' LYS . 5.7 t-20 -113.21 141.33 47.09 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 172.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -96.31 111.71 23.69 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.732 0.301 . . . . 0.0 111.806 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 115' ' ' GLY . 1.8 tp10 -62.05 149.7 40.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.099 177.283 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.621 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 89.86 -108.4 3.51 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.583 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.53 -161.46 32.68 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' MET . . . . . 0.434 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 35.9 tpp -60.5 -32.65 71.65 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.042 0.448 . . . . 0.0 110.725 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -61.79 -33.91 74.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.268 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.621 ' HD3' ' HA3' ' A' ' 115' ' ' GLY . 0.0 OUTLIER -73.85 -33.13 63.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 111.42 0.155 . . . . 0.0 111.42 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.769 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -62.77 -54.04 45.11 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 15.6 mt -62.12 -43.81 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.378 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -74.79 -33.42 62.25 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -172.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -76.94 3.24 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 122.269 -0.269 . . . . 0.0 111.669 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.11 18.55 74.33 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.359 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 120' ' ' TRP . 86.8 mt -76.52 154.24 83.75 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-O 120.834 0.349 . . . . 0.0 110.552 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.481 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 26.4 Cg_endo -57.98 111.25 0.79 Allowed 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 123.066 2.511 . . . . 0.0 111.951 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.84 146.97 47.08 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.88 101.55 13.24 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.02 142.45 49.57 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.915 -175.529 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.71 70.06 10.75 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.52 104.51 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.983 -176.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -122.5 136.17 54.82 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.616 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -116.48 -3.25 11.88 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.579 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 23.6 t60 -80.09 64.87 5.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.024 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -163.96 130.43 3.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.083 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.47 -52.59 2.77 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 173.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.254 1.339 0 CA-C-O 117.61 -1.186 . . . . 0.0 108.777 172.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.058 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -149.35 127.78 12.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.354 0.597 . . . . 0.0 109.898 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' MET . . . . . 0.604 ' SD ' ' HG3' ' B' ' 6' ' ' LYS . 4.8 tpp -112.75 24.14 12.75 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.066 -176.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLY . . . . . 0.756 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.05 -49.19 81.11 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.599 -0.728 . . . . 0.0 113.276 -177.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -31.91 68.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.064 0.459 . . . . 0.0 111.117 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.604 ' HG3' ' SD ' ' B' ' 3' ' ' MET . 15.0 mmtp -75.57 -57.99 3.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.406 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.756 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -79.23 -23.6 43.63 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.858 -0.737 . . . . 0.0 112.485 -174.489 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ASP . . . . . 0.439 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 17.8 t0 -53.82 -42.45 68.44 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.996 0.427 . . . . 0.0 110.536 -178.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.44 -35.34 68.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.307 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.06 -47.53 68.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.458 0.171 . . . . 0.0 111.417 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' PHE . . . . . 0.568 ' CD2' HD22 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -57.23 -38.47 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.29 0.567 . . . . 0.0 110.317 179.563 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 12' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.1 OUTLIER -68.08 -27.06 66.16 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.371 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.91 -44.29 49.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -69.74 -50.59 41.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.29 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.582 HG11 ' HG2' ' A' ' 71' ' ' GLU . 0.9 OUTLIER -61.57 -33.27 56.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.304 -178.628 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.575 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -71.69 -33.73 69.06 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.423 179.485 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.54 64.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.122 0.486 . . . . 0.0 110.888 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.73 -32.84 70.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.061 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.39 -24.2 42.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.06 0.457 . . . . 0.0 111.024 173.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.38 -26.19 46.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.057 -176.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.574 ' O ' ' HD3' ' B' ' 103' ' ' ARG . 3.8 t0 -85.86 21.03 2.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.659 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 9.7 mtp -143.38 156.03 44.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.468 -178.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 61.2 t -81.76 100.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' MET . . . . . 0.408 ' SD ' ' HG2' ' B' ' 114' ' ' GLU . 0.0 OUTLIER -74.67 112.85 11.28 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.168 0.509 . . . . 0.0 111.111 -174.75 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 25' ' ' LEU . . . . . 0.47 ' HA ' HD23 ' B' ' 25' ' ' LEU . 2.5 mt -123.76 144.81 49.46 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.198 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 141.71 49.18 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.203 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.441 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 1.6 Cg_endo -46.77 -24.17 2.86 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.404 3.403 . . . . 0.0 115.083 -174.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -74.43 -43.78 54.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.0 0.428 . . . . 0.0 110.626 177.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -72.65 -32.56 65.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.009 175.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.656 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -66.09 -52.2 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.778 178.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' TYR . . . . . 0.798 ' HA ' HD12 ' B' ' 34' ' ' LEU . 59.8 t80 -63.66 -29.87 71.05 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 122.221 -0.299 . . . . 0.0 111.063 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -52.75 63.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.056 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.651 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.2 OUTLIER -68.95 -26.51 65.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.259 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' B' ' 31' ' ' TYR . 46.8 mt -70.62 -49.69 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.023 0.439 . . . . 0.0 111.261 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -76.28 -24.65 54.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.233 -173.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.65 -34.19 15.53 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.129 -178.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.53 ' HB2' HG13 ' B' ' 40' ' ' ILE . 0.5 OUTLIER -126.64 102.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.563 -177.46 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -70.23 8.29 0.91 Allowed 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 123.327 2.685 . . . . 0.0 113.947 -176.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -92.33 -27.41 17.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.283 0.563 . . . . 0.0 109.588 173.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.913 HG12 ' HG2' ' B' ' 84' ' ' PRO . 2.8 mt -82.53 99.41 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.841 175.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.631 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -90.28 145.17 25.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.362 -176.096 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.928 HD11 ' HB2' ' B' ' 88' ' ' PHE . 2.5 tp -102.89 130.3 49.89 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.564 HG12 ' HE2' ' B' ' 65' ' ' MET . 94.4 mt -109.01 118.7 57.12 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.807 178.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.825 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -97.13 122.48 40.18 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.633 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.56 98.41 6.43 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 115.045 -0.98 . . . . 0.0 108.632 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ARG . . . . . 0.634 ' HG3' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -161.41 169.89 21.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.993 -174.123 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.96 142.44 76.31 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 177.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -78.81 -19.23 11.22 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.683 2.255 . . . . 0.0 114.028 -174.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.41 -48.88 25.04 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 122.097 -0.377 . . . . 0.0 111.391 -176.002 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' GLU . . . . . 0.454 ' HG3' ' HB2' ' A' ' 49' ' ' ASP . 0.9 OUTLIER -67.74 -29.33 68.53 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 174.561 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -44.5 97.11 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.051 174.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -59.39 -38.68 81.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.98 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.61 -47.98 10.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.823 -171.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.71 -34.68 11.85 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -170.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.87 163.64 11.31 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.655 178.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.04 152.58 70.32 Favored Pre-proline 0 C--N 1.327 -0.4 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -58.39 122.79 12.27 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.521 2.147 . . . . 0.0 112.893 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -98.61 79.72 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.339 0.59 . . . . 0.0 110.272 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.631 HG22 ' HB2' ' B' ' 62' ' ' TYR . 1.2 m -113.43 162.78 11.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 178.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -41.33 88.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.315 -174.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.434 ' HB2' HG23 ' B' ' 41' ' ' THR . 19.9 p30 -121.26 67.84 0.88 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.522 0.677 . . . . 0.0 111.208 -177.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' TYR . . . . . 0.825 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -105.52 125.32 50.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.808 176.736 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.631 ' HE2' HG21 ' B' ' 41' ' ' THR . 3.7 mtmt -123.01 120.88 34.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.004 0.431 . . . . 0.0 110.617 176.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 64' ' ' HIS . . . . . 0.464 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 12.9 t-160 -87.22 113.69 23.18 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' MET . . . . . 0.923 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.1 OUTLIER -105.68 91.78 3.9 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.17 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -107.29 107.93 19.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.245 0.545 . . . . 0.0 112.212 -172.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 67' ' ' ARG . . . . . 0.694 ' HG2' ' HG2' ' B' ' 72' ' ' PRO . 1.1 tpt180 -144.47 -129.43 0.08 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 170.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' GLY . . . . . 0.439 ' HA3' HG22 ' A' ' 91' ' ' THR . . . -85.51 -44.22 6.24 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 119.242 -1.456 . . . . 0.0 109.768 169.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' LYS . . . . . 0.436 ' HE3' ' HA ' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -152.21 44.13 0.71 Allowed 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.19 -0.505 . . . . 0.0 110.288 173.575 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.795 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.0 OUTLIER 68.66 -6.16 0.88 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 173.37 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.653 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -44.79 -59.49 4.05 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -174.836 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.694 ' HG2' ' HG2' ' B' ' 67' ' ' ARG . 11.9 Cg_exo -73.93 -17.38 22.52 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.453 2.102 . . . . 0.0 113.392 -176.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.923 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -91.11 -21.88 20.98 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.73 0.3 . . . . 0.0 110.636 -177.502 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.672 HD21 HD21 ' B' ' 102' ' ' LEU . 10.6 tp -62.34 -29.02 70.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.452 0.644 . . . . 0.0 110.885 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.713 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -77.22 -30.24 54.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.782 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.45 -7.18 32.19 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -171.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -27.02 57.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.807 0.337 . . . . 0.0 111.483 -176.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.15 51.23 2.45 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.306 -174.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 49.7 mt -109.46 142.79 39.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.914 0.387 . . . . 0.0 110.201 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.457 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 16.9 t70 -136.1 138.93 28.7 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.377 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 81' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 48.7 Cg_exo -60.95 16.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.631 2.887 . . . . 0.0 114.549 -175.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.453 ' HG2' ' OD2' ' B' ' 80' ' ' ASP . 0.2 OUTLIER -107.68 -6.38 16.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 174.932 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 83' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 28.6 mttm -103.86 143.85 27.49 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.986 -175.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.913 ' HG2' HG12 ' B' ' 40' ' ' ILE . 8.4 Cg_endo -83.12 141.01 10.19 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 C-N-CA 122.98 2.453 . . . . 0.0 111.108 174.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.0 OUTLIER -140.45 146.79 23.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.43 -178.324 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.509 ' CG1' HD21 ' B' ' 34' ' ' LEU . 2.2 p -124.79 140.3 48.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' VAL . . . . . 0.877 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 4.2 m -107.23 125.51 63.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.656 -177.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.928 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.7 t80 -99.85 150.24 22.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.354 -178.205 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 89' ' ' CYS . . . . . 0.634 ' SG ' ' HG3' ' B' ' 46' ' ' ARG . 0.1 OUTLIER 75.26 67.68 0.08 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.459 0.647 . . . . 0.0 111.701 -179.376 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.509 ' HA ' ' H ' ' B' ' 95' ' ' ALA . 0.3 OUTLIER -84.15 -1.78 55.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.366 178.021 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 91' ' ' THR . . . . . 0.508 ' HB ' ' H ' ' B' ' 92' ' ' ALA . 0.0 OUTLIER -77.25 -109.09 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.956 -175.091 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.612 ' HA ' ' O ' ' A' ' 68' ' ' GLY . . . -63.9 -46.04 86.65 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -175.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.17 -27.73 64.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.835 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.99 71.02 0.55 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.85 177.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.877 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -65.22 -11.21 38.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.141 176.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.34 -32.69 66.98 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.145 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -71.35 -27.9 63.69 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.079 0.466 . . . . 0.0 110.81 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' ALA . . . . . 0.415 ' HB1' HD22 ' B' ' 70' ' ' LEU . . . -73.47 -44.58 57.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.931 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -87.05 -40.93 6.84 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.782 -174.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 100' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -66.6 -29.54 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.004 0.402 . . . . 0.0 111.295 -174.883 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 101' ' ' THR . . . . . 0.473 ' HA ' ' HG3' ' B' ' 104' ' ' GLU . 8.0 m -72.74 -35.66 67.57 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.939 0.4 . . . . 0.0 111.127 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 102' ' ' LEU . . . . . 0.672 HD21 HD21 ' B' ' 74' ' ' LEU . 11.2 mt -66.61 -37.01 83.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 103' ' ' ARG . . . . . 0.574 ' HD3' ' O ' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -67.03 -25.07 66.09 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 179.194 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.473 ' HG3' ' HA ' ' B' ' 101' ' ' THR . 2.5 mt-10 -68.73 -6.6 27.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.23 174.696 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 105' ' ' TYR . . . . . 0.489 ' CE1' ' HB ' ' A' ' 10' ' ' THR . 17.2 m-85 -110.18 -11.2 14.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.68 0.276 . . . . 0.0 110.744 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 97.75 60.47 0.93 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.349 -0.929 . . . . 0.0 113.2 174.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' PHE . . . . . 0.532 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.1 m-85 -92.46 158.16 16.18 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.745 -0.268 . . . . 0.0 110.291 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -61.26 -70.27 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.535 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.6 113.97 9.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 178.283 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 110' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.3 tt -113.06 123.5 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.625 0.726 . . . . 0.0 110.936 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 111' ' ' TYR . . . . . 0.415 ' O ' ' HA ' ' B' ' 86' ' ' VAL . 1.3 m-85 -113.99 146.81 39.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.271 -176.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.404 ' OD1' ' HB3' ' B' ' 90' ' ' LYS . 24.3 t-20 -111.33 138.67 47.52 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.496 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 8.4 m -87.57 111.84 21.64 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.982 0.42 . . . . 0.0 112.038 -174.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.408 ' HG2' ' SD ' ' B' ' 24' ' ' MET . 0.8 OUTLIER -63.21 148.28 48.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.253 177.081 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 85.38 -109.23 3.29 Favored Glycine 0 N--CA 1.442 -0.95 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.175 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 116' ' ' GLY . . . . . 0.588 ' HA3' ' S5 ' ' B' ' 139' ' ' PS5 . . . 162.57 -157.77 29.79 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 117' ' ' MET . . . . . 0.453 ' HB3' ' S3 ' ' B' ' 139' ' ' PS5 . 3.0 tmm? -60.6 -33.89 73.41 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.122 0.486 . . . . 0.0 110.144 177.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.585 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.52 -34.5 74.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.854 179.294 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 119' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -72.74 -32.38 65.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.535 0.207 . . . . 0.0 111.384 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.759 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 20.2 t-105 -64.39 -54.63 29.78 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.84 -43.41 98.86 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.499 0.19 . . . . 0.0 111.163 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.585 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.6 OUTLIER -63.09 -33.08 74.69 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.898 -176.252 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 123' ' ' GLU . . . . . 0.599 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -82.96 -3.91 57.67 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.992 -177.28 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.18 27.75 73.6 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.672 -178.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.599 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 70.1 mt -72.47 161.97 76.36 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.273 . . . . 0.0 110.283 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.597 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 21.8 Cg_endo -57.21 108.68 0.38 Allowed 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.851 2.367 . . . . 0.0 111.642 178.51 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.63 149.99 51.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 2.7 mt -103.15 101.2 11.15 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -135.36 143.61 46.19 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.868 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 130' ' ' ARG . . . . . 0.448 ' O ' ' HD2' ' B' ' 132' ' ' HIS . 8.0 ttt180 -91.84 103.15 15.73 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 179.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.61 125.95 18.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.715 -178.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 132' ' ' HIS . . . . . 0.448 ' HD2' ' O ' ' B' ' 130' ' ' ARG . 24.7 m170 -75.45 54.28 0.73 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.542 -175.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -88.82 60.62 5.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.129 0.49 . . . . 0.0 111.377 -177.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -151.87 29.75 0.59 Allowed 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.321 174.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.45 117.17 11.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.628 -178.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 49.0 p-80 -127.98 -5.01 5.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.249 0.547 . . . . 0.0 109.818 176.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 . . . . . 0 C--O 1.248 1.025 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.186 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 138' ' ' PS5 . . . . . 0.467 ' S5 ' ' HB ' ' A' ' 91' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 139' ' ' PS5 . . . . . 0.588 ' S5 ' ' HA3' ' B' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 120.652 0.263 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -83.8 45.1 1.04 Allowed 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -175.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.1 mmt -76.57 -13.71 60.06 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.659 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -52.16 -26.57 20.92 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 114.39 -1.277 . . . . 0.0 113.214 -179.195 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -33.27 57.62 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.542 ' HG3' ' N ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -61.29 -46.57 89.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.395 . . . . 0.0 112.001 -174.845 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.659 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 1.8 p90 -91.52 -20.51 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.821 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.51 -50.57 65.13 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 110.911 -177.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.71 -32.11 73.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.513 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -42.68 72.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.495 178.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.608 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.1 OUTLIER -56.82 -38.27 72.36 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.144 0.497 . . . . 0.0 110.152 176.435 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -32.17 73.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.652 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.32 -45.33 32.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.763 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -68.86 -51.45 40.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.657 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.44 HG11 ' CD ' ' B' ' 69' ' ' LYS . 22.3 t -61.97 -34.13 61.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.945 -176.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -58.7 -35.24 72.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.552 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -28.99 69.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 111.217 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.7 -31.75 61.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.622 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.54 ' HG3' ' SD ' ' A' ' 24' ' ' MET . 0.6 OUTLIER -76.9 -24.02 52.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.664 0.745 . . . . 0.0 110.119 173.74 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.9 -17.4 53.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.676 -178.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.602 ' HB3' ' HB2' ' A' ' 100' ' ' LYS . 0.4 OUTLIER -86.58 19.04 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -175.634 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.443 ' SD ' ' HA ' ' A' ' 96' ' ' ALA . 0.1 OUTLIER -149.35 157.68 43.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.537 178.197 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -75.7 103.05 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.179 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.574 ' SD ' ' HG2' ' A' ' 114' ' ' GLU . 1.4 mmt -72.07 125.9 28.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.693 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -141.65 152.58 44.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.322 -178.033 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 139.8 37.13 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.774 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -50.46 -19.38 4.72 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.578 2.852 . . . . 0.0 113.982 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -46.01 51.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.848 0.356 . . . . 0.0 111.066 176.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.49 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 1.2 t70 -77.39 -29.32 53.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.971 0.415 . . . . 0.0 110.458 178.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.94 -36.25 77.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.43 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -74.38 -39.76 62.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.777 -177.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 29' ' ' ASP . 2.4 pttt -63.08 -41.08 99.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.98 -0.288 . . . . 0.0 111.592 -174.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.536 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -74.19 -26.19 60.13 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.764 0.316 . . . . 0.0 110.612 176.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.698 HD11 ' HB2' ' A' ' 42' ' ' LEU . 4.6 mt -61.16 -54.43 44.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.408 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -75.8 -28.32 58.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.547 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.528 ' HG2' ' HA ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -84.6 -22.65 29.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.825 0.345 . . . . 0.0 111.158 -176.166 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -121.05 106.83 38.37 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.209 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -67.69 -0.94 5.89 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.817 2.345 . . . . 0.0 112.288 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.49 -25.33 15.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.066 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.624 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 53.6 mt -84.84 111.5 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.067 176.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.728 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -106.71 144.91 32.68 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.967 -176.647 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 1.0 HD11 ' HB2' ' A' ' 88' ' ' PHE . 25.8 tp -101.94 125.97 48.74 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.464 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 4.1 mt -108.96 106.24 20.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.176 174.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.784 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 3.6 t0 -83.2 125.18 31.28 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.674 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -110.31 97.19 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.603 0.716 . . . . 0.0 109.122 -178.731 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.55 ' HD2' ' SD ' ' A' ' 117' ' ' MET . 0.0 OUTLIER -162.51 -164.27 1.0 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.405 -176.0 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.484 ' CG ' HH12 ' B' ' 46' ' ' ARG . 11.7 m-20 -119.92 143.87 36.18 Favored Pre-proline 0 C--N 1.325 -0.472 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -177.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -65.68 -24.34 55.3 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 123.064 2.509 . . . . 0.0 114.194 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.82 -48.06 34.09 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.359 -176.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -27.35 64.56 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.137 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.28 -43.3 99.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.943 173.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -59.97 -35.95 76.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.578 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.15 -37.31 23.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.336 -175.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.3 mmm -100.47 -34.4 9.95 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -173.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 119.19 169.01 14.2 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 121.138 -0.553 . . . . 0.0 112.059 -178.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.475 ' HG3' ' HB2' ' A' ' 128' ' ' LEU . 6.2 pttt -138.3 158.07 71.44 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HB3' ' CZ2' ' A' ' 120' ' ' TRP . 19.8 Cg_exo -68.2 133.87 29.86 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.315 2.01 . . . . 0.0 113.137 -176.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.638 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 21.3 t0 -97.13 86.42 3.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 176.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.584 HG22 ' HB2' ' A' ' 62' ' ' TYR . 6.5 m -133.28 159.66 42.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.307 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.928 -175.199 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.517 ' HB3' HG23 ' A' ' 41' ' ' THR . 0.3 OUTLIER -116.99 84.34 2.13 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.902 0.382 . . . . 0.0 110.737 -177.302 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.784 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 5.8 t80 -125.51 126.94 45.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.401 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.728 ' HE2' HG21 ' A' ' 41' ' ' THR . 8.5 mttm -127.34 126.88 43.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.231 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -96.59 120.96 37.86 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.503 0.192 . . . . 0.0 110.668 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.738 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -118.87 104.92 10.99 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 177.783 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.427 ' HB3' ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -130.67 179.83 5.72 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -171.547 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.485 ' C ' ' H ' ' A' ' 69' ' ' LYS . 6.6 ttp180 60.38 -96.25 0.06 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.834 176.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.437 ' H ' ' HB3' ' A' ' 67' ' ' ARG . . . -55.46 17.13 0.01 OUTLIER Glycine 0 CA--C 1.526 0.744 0 N-CA-C 116.642 1.417 . . . . 0.0 116.642 -166.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.633 ' HD3' ' HB3' ' B' ' 92' ' ' ALA . 1.4 mtmp? 82.25 16.41 0.41 Allowed 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.852 0.861 . . . . 0.0 108.812 -175.518 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.738 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.1 OUTLIER 71.16 -26.52 0.17 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 113.947 -1.479 . . . . 0.0 112.483 -178.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.702 ' HG3' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -53.51 -42.76 93.58 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.455 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.702 ' HD3' ' HG3' ' A' ' 71' ' ' GLU . 9.7 Cg_exo -71.95 -18.06 28.13 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.573 1.516 . . . . 0.0 111.856 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -97.6 -21.81 16.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.81 -176.746 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.677 HD21 HD21 ' A' ' 102' ' ' LEU . 15.3 tp -55.14 -56.63 17.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.971 -177.01 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.33 -19.91 64.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.039 -175.111 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -85.2 -12.26 53.07 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.51 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 20.3 m -105.42 35.9 2.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -173.098 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.04 56.98 5.0 Favored Glycine 0 C--N 1.335 0.474 0 O-C-N 123.365 0.415 . . . . 0.0 113.526 174.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.522 HD23 ' HA ' ' A' ' 79' ' ' LEU . 4.6 mt -109.19 140.98 42.09 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.769 0.319 . . . . 0.0 110.79 -178.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.55 154.64 76.89 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -68.74 2.67 2.79 Favored 'Trans proline' 0 CA--C 1.529 0.231 0 C-N-CA 122.802 2.335 . . . . 0.0 113.752 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.9 26.09 10.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.368 0.604 . . . . 0.0 110.176 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.8 mmtm -107.26 115.94 58.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -178.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.624 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 5.8 Cg_exo -74.06 103.75 1.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.574 2.182 . . . . 0.0 109.951 173.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.546 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 15.6 m -123.16 154.91 28.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.468 0.652 . . . . 0.0 111.79 -171.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.447 ' O ' HD12 ' A' ' 42' ' ' LEU . 1.4 p -122.68 145.48 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.766 174.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 43' ' ' ILE . 5.2 m -110.1 129.78 64.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 1.0 ' HB2' HD11 ' A' ' 42' ' ' LEU . 5.2 t80 -104.87 133.66 49.3 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.176 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' CYS . . . . . 0.524 ' SG ' ' HB3' ' A' ' 93' ' ' ALA . 35.5 t 173.11 175.69 0.11 Allowed 'General case' 0 C--O 1.234 0.283 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 -177.469 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.812 ' HA ' ' HA2' ' A' ' 116' ' ' GLY . 0.0 OUTLIER -55.59 -61.4 2.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.938 0.399 . . . . 0.0 110.381 178.955 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -165.55 -101.37 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.299 176.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.452 ' HA ' ' HB2' ' A' ' 96' ' ' ALA . . . -95.93 27.42 3.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.132 0.491 . . . . 0.0 111.171 179.123 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.524 ' HB3' ' SG ' ' A' ' 89' ' ' CYS . . . -74.72 -54.06 8.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.487 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.665 HH12 ' HB1' ' B' ' 93' ' ' ALA . 0.1 OUTLIER -136.99 -46.1 0.58 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.114 179.684 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.674 ' HA ' HG21 ' A' ' 45' ' ' VAL . . . -54.69 -35.8 63.98 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -174.167 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.452 ' HB2' ' HA ' ' A' ' 92' ' ' ALA . . . -57.1 -36.94 71.23 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.73 -35.33 77.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.525 0.202 . . . . 0.0 111.175 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.474 ' HB2' HD22 ' A' ' 70' ' ' LEU . . . -75.01 -53.44 8.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.124 0.488 . . . . 0.0 110.926 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.44 -53.97 25.77 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.719 -175.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -62.88 -37.33 86.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.682 0.277 . . . . 0.0 111.176 -173.192 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.529 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 11.0 m -72.43 -39.52 67.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.677 HD21 HD21 ' A' ' 74' ' ' LEU . 11.7 mt -64.83 -47.7 77.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.689 0.28 . . . . 0.0 111.422 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.813 ' HA ' ' HB2' ' A' ' 107' ' ' PHE . 1.7 ptm180 -63.6 -27.08 68.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.102 0.477 . . . . 0.0 110.734 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.73 -5.42 25.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.232 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -110.68 -6.64 14.78 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.197 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.56 31.62 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.919 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.813 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 2.3 m-85 -81.56 142.5 32.77 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.436 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.1 tttt -62.88 -87.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.445 -176.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.436 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -116.45 120.88 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.371 -177.2 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.546 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 0.5 OUTLIER -125.52 129.42 72.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -178.844 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -118.6 154.55 32.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.327 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -131.27 158.49 40.47 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -82.09 139.14 34.59 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.113 0.482 . . . . 0.0 111.478 -176.31 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.574 ' HG2' ' SD ' ' A' ' 24' ' ' MET . 0.0 OUTLIER -99.68 18.81 17.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 176.595 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.76 -75.73 0.16 Allowed Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.928 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.812 ' HA2' ' HA ' ' A' ' 90' ' ' LYS . . . 150.34 174.86 21.88 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.014 -0.613 . . . . 0.0 111.96 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' MET . . . . . 0.55 ' SD ' ' HD2' ' A' ' 46' ' ' ARG . 19.7 ttm -64.9 -36.37 84.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.419 0.628 . . . . 0.0 109.753 176.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -64.38 -27.78 69.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.044 177.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -69.37 -32.44 71.48 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 116.791 -0.186 . . . . 0.0 111.107 -179.165 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.675 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 27.8 t-105 -56.2 -52.29 64.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.417 ' HA ' HD23 ' A' ' 121' ' ' LEU . 3.3 mt -66.03 -40.86 91.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.444 178.256 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -68.13 -43.07 79.17 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.725 -175.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 119' ' ' LYS . 65.1 mt-10 -69.69 -18.12 63.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.763 0.316 . . . . 0.0 110.816 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 93.65 25.04 19.21 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.488 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.2 mt -80.45 152.46 73.05 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.638 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 13.8 Cg_endo -56.32 120.89 9.06 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 123.154 2.569 . . . . 0.0 112.286 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.63 157.29 45.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.469 -177.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.475 ' HB2' ' HG3' ' A' ' 56' ' ' LYS . 2.9 mt -110.62 101.66 10.3 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.09 178.452 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -132.49 132.72 42.97 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.63 -50.38 0.62 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.195 0.598 . . . . 0.0 111.9 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.4 m 62.28 81.61 0.19 Allowed 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.215 0.606 . . . . 0.0 110.679 -179.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -64.35 -57.26 9.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.455 -177.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -166.2 127.23 1.77 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.008 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -110.72 -23.09 11.25 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.071 0.462 . . . . 0.0 110.148 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -136.46 146.03 45.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.016 177.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -109.76 -13.29 14.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.598 0.713 . . . . 0.0 109.405 177.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 117.645 -1.169 . . . . 0.0 108.327 -179.595 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.779 0.323 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -150.76 -36.23 0.14 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.989 0.423 . . . . 0.0 110.709 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.65 -3.07 55.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.918 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' GLY . . . . . 0.67 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -56.46 -27.07 53.25 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.469 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -74.61 -33.92 62.72 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.892 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.498 ' HG3' ' N ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -64.59 -47.05 80.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.872 -174.793 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.67 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 11.8 p90 -84.44 -24.26 29.6 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.38 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.85 -48.37 70.04 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.788 -178.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.23 -43.61 98.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.407 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -43.09 99.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.736 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' PHE . . . . . 0.566 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 2.1 t80 -56.48 -41.24 76.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.292 0.568 . . . . 0.0 110.339 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' LYS . . . . . 0.653 ' HD2' ' HB2' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.87 -26.97 67.88 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.756 179.361 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.81 -40.57 61.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.075 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -71.28 -50.43 32.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.317 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -33.45 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.146 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -66.79 -40.19 88.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.794 0.33 . . . . 0.0 111.268 178.026 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.54 -26.32 68.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.447 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.8 71.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.6 -178.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -21.35 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.03 0.443 . . . . 0.0 111.092 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.0 -19.65 62.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.33 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.403 ' OD1' ' HD3' ' B' ' 103' ' ' ARG . 2.6 t70 -78.42 -9.26 59.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.953 0.406 . . . . 0.0 111.345 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.588 ' HE1' ' HA3' ' B' ' 99' ' ' GLY . 11.8 mtp -116.93 165.7 13.03 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 122.212 -0.305 . . . . 0.0 110.998 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.53 111.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 174.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' MET . . . . . 0.685 ' HB3' ' HG3' ' B' ' 114' ' ' GLU . 0.7 OUTLIER -78.67 105.43 9.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.869 -175.109 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 25' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' B' ' 25' ' ' LEU . 0.5 OUTLIER -121.78 148.26 44.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.505 0.669 . . . . 0.0 111.333 -177.039 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.99 137.05 33.37 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.207 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -41.09 -31.65 0.86 Allowed 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 124.632 3.555 . . . . 0.0 115.388 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.647 ' HG3' ' OE1' ' B' ' 123' ' ' GLU . 13.5 mtmm -73.43 -40.86 63.9 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.41 0.55 . . . . 0.0 110.738 178.397 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -69.66 -34.91 74.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.151 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.1 -43.27 78.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.362 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' TYR . . . . . 0.437 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 73.2 t80 -67.07 -31.09 71.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.327 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 tptt -61.58 -52.73 63.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.825 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.533 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -72.26 -26.62 62.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 179.755 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.664 HD11 ' HB2' ' B' ' 42' ' ' LEU . 5.1 mt -59.55 -55.39 35.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.0 mm100 -74.1 -32.88 63.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.174 -175.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.98 -40.67 68.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.259 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -108.5 113.61 59.93 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.371 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.45 -3.61 12.16 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 0.0 112.913 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -103.89 -16.64 15.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.538 -178.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.533 HD12 ' HB2' ' B' ' 33' ' ' LEU . 16.3 mt -81.12 109.02 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-O 121.25 0.548 . . . . 0.0 109.927 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.673 HG21 ' HE2' ' B' ' 63' ' ' LYS . 97.0 m -97.68 142.59 29.29 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.262 -176.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.867 HD11 ' HB2' ' B' ' 88' ' ' PHE . 11.3 tp -103.8 126.45 50.94 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 169.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.85 118.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.793 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -95.16 126.45 40.5 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.619 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -115.63 97.77 6.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.677 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ARG . . . . . 0.484 HH12 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -168.48 179.92 4.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.558 -177.738 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -98.68 154.79 37.3 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.237 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.28 -19.19 38.74 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.736 2.291 . . . . 0.0 113.452 -176.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -45.43 23.77 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.484 -178.006 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -30.63 63.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.67 -46.53 88.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.751 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.57 -31.83 71.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -85.06 -37.24 20.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 5.5 mtm -98.93 -19.51 17.29 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -172.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 98.77 165.62 30.47 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.729 -175.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -143.58 145.01 29.71 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.458 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 13.8 Cg_endo -61.57 135.55 57.6 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.846 2.364 . . . . 0.0 112.724 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -112.32 84.24 1.94 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.378 178.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.488 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.5 m -121.69 167.22 15.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.381 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 mttm -60.43 -47.9 84.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -174.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.72 71.06 0.76 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.143 0.496 . . . . 0.0 110.906 -177.475 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' TYR . . . . . 0.793 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -114.92 131.59 56.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 177.239 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.673 ' HE2' HG21 ' B' ' 41' ' ' THR . 1.0 OUTLIER -133.8 126.84 31.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.261 0.553 . . . . 0.0 110.313 179.018 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -82.16 122.16 27.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.79 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' MET . . . . . 0.808 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.7 OUTLIER -139.79 100.43 3.95 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.223 -177.673 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -149.98 -161.87 1.43 Allowed 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 121.162 -0.215 . . . . 0.0 111.481 -176.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 67' ' ' ARG . . . . . 0.581 ' C ' ' H ' ' B' ' 69' ' ' LYS . 0.2 OUTLIER 61.32 -95.74 0.05 Allowed 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.871 0.732 . . . . 0.0 111.464 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 68' ' ' GLY . . . . . 0.41 ' H ' ' HB3' ' B' ' 67' ' ' ARG . . . -57.86 18.31 0.02 OUTLIER Glycine 0 C--N 1.339 0.702 0 C-N-CA 123.937 0.779 . . . . 0.0 114.96 -171.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 69' ' ' LYS . . . . . 0.581 ' H ' ' C ' ' B' ' 67' ' ' ARG . 1.1 mtmp? 81.9 16.4 0.45 Allowed 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 124.367 1.067 . . . . 0.0 108.86 -174.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.596 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.3 OUTLIER 64.36 -26.54 0.08 Allowed 'General case' 0 C--N 1.346 0.455 0 C-N-CA 125.039 1.336 . . . . 0.0 113.365 175.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.475 ' HG3' ' H ' ' B' ' 71' ' ' GLU . 0.0 OUTLIER -50.2 -46.55 83.03 Favored Pre-proline 0 N--CA 1.474 0.755 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.483 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.459 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 34.1 Cg_exo -61.24 -18.55 59.29 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.969 1.779 . . . . 0.0 112.454 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.808 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -105.68 -21.14 13.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 0.0 110.52 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.577 HD21 HD21 ' B' ' 102' ' ' LEU . 9.7 tp -64.36 -33.32 75.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.536 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.65 -24.29 45.27 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.81 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 35.1 mtpt -86.69 -2.53 58.6 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -175.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 77' ' ' SER . . . . . 0.594 ' HB3' ' HD2' ' B' ' 63' ' ' LYS . 20.1 m -116.55 35.59 4.5 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 38.44 56.25 1.97 Allowed Glycine 0 C--N 1.338 0.661 0 O-C-N 123.626 0.579 . . . . 0.0 114.151 173.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 73.6 mt -103.25 140.04 37.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 0.0 110.542 -178.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.651 ' HB2' ' HG3' ' B' ' 83' ' ' LYS . 11.0 m-20 -126.06 140.71 37.59 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 81' ' ' PRO . . . . . 0.534 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 38.6 Cg_endo -66.16 6.34 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.812 2.342 . . . . 0.0 113.162 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.491 ' H ' ' HG3' ' B' ' 82' ' ' GLU . 0.9 OUTLIER -105.87 -7.02 18.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.942 0.401 . . . . 0.0 110.727 176.55 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 83' ' ' LYS . . . . . 0.651 ' HG3' ' HB2' ' B' ' 80' ' ' ASP . 3.0 mttp -96.13 133.22 25.42 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.837 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.486 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.9 Cg_exo -72.56 123.04 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.645 2.23 . . . . 0.0 111.382 176.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 25.6 m -128.5 155.53 40.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.85 0.357 . . . . 0.0 110.717 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.529 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 1.4 p -129.99 144.04 39.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 12.0 m -105.83 129.31 59.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.895 0.378 . . . . 0.0 110.433 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.867 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.3 t80 -105.84 130.04 53.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.666 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 89' ' ' CYS . . . . . 0.663 ' HB3' ' HB2' ' B' ' 95' ' ' ALA . 0.0 OUTLIER 156.66 170.28 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 125.194 1.559 . . . . 0.0 107.087 -177.589 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.504 ' N ' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -61.36 121.79 13.53 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.375 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 91' ' ' THR . . . . . 0.614 HG22 ' HE1' ' B' ' 24' ' ' MET . 0.2 OUTLIER -11.93 -82.21 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -174.833 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.633 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . . . -104.51 20.72 18.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.946 -175.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.665 ' HB1' HH12 ' A' ' 94' ' ' ARG . . . -75.59 -36.77 60.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.844 0.354 . . . . 0.0 110.969 178.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.69 -29.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.675 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.663 ' HB2' ' HB3' ' B' ' 89' ' ' CYS . . . -59.11 -37.34 76.95 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.31 -178.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.59 75.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.255 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -68.22 -30.79 69.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.028 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.68 -38.39 54.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.707 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 99' ' ' GLY . . . . . 0.588 ' HA3' ' HE1' ' B' ' 22' ' ' MET . . . -96.61 -41.85 3.52 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.939 -171.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -24.6 67.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.011 0.434 . . . . 0.0 110.867 -176.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.86 -53.94 11.66 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.574 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 102' ' ' LEU . . . . . 0.577 HD21 HD21 ' B' ' 74' ' ' LEU . 32.2 mt -55.28 -44.6 75.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.797 -175.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 103' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.0 OUTLIER -64.96 -31.17 72.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 110.811 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -75.52 -6.71 51.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.222 176.113 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 105' ' ' TYR . . . . . 0.608 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 16.5 m-30 -99.91 -11.36 20.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.953 0.406 . . . . 0.0 110.132 177.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.09 25.75 2.2 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.096 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' PHE . . . . . 0.595 ' HB2' ' HA ' ' B' ' 103' ' ' ARG . 2.3 m-85 -76.09 152.0 36.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 0.0 110.661 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -75.55 -77.7 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.335 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.39 109.31 13.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.005 0.431 . . . . 0.0 110.931 -178.199 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' ILE . . . . . 0.457 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.8 tt -114.57 129.68 70.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.587 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 111' ' ' TYR . . . . . 0.529 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 4.1 m-85 -113.37 143.72 44.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.056 -174.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.58 ' HB3' ' HE3' ' B' ' 24' ' ' MET . 19.5 t-20 -113.68 140.3 48.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 173.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.444 ' OG ' ' HD1' ' B' ' 88' ' ' PHE . 15.7 m -83.01 108.32 16.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.816 0.341 . . . . 0.0 111.634 -176.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.685 ' HG3' ' HB3' ' B' ' 24' ' ' MET . 0.5 OUTLIER -71.99 30.16 0.05 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.645 -176.012 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 115' ' ' GLY . . . . . 0.555 ' HA3' ' HG2' ' B' ' 119' ' ' LYS . . . -145.1 -73.83 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.28 178.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 135.01 -177.63 19.17 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.675 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.89 -32.57 72.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.207 0.527 . . . . 0.0 110.812 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 30.0 p-10 -66.24 -28.85 69.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.936 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 119' ' ' LYS . . . . . 0.555 ' HG2' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -74.11 -33.21 63.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.301 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.772 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 19.3 t-105 -58.93 -49.91 76.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.913 0.387 . . . . 0.0 110.314 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.1 mt -68.67 -36.86 79.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.972 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.7 OUTLIER -68.32 -44.53 75.19 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.943 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 123' ' ' GLU . . . . . 0.647 ' OE1' ' HG3' ' B' ' 28' ' ' LYS . 68.1 mt-10 -80.1 8.61 6.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -176.175 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.58 21.36 77.28 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.245 172.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.479 HD21 ' HG2' ' B' ' 28' ' ' LYS . 96.0 mt -79.75 158.92 72.52 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-O 120.708 0.289 . . . . 0.0 111.001 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.438 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 41.5 Cg_endo -65.51 107.8 1.09 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.878 2.385 . . . . 0.0 112.326 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.84 150.39 46.46 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.86 100.75 4.89 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 178.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -135.81 92.79 2.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.881 -175.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.85 -88.8 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.321 -0.854 . . . . 0.0 112.428 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.7 m 62.04 -108.55 0.3 Allowed 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.892 0.477 . . . . 0.0 110.516 -179.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 132' ' ' HIS . . . . . 0.453 ' HB3' ' H ' ' B' ' 133' ' ' HIS . 0.1 OUTLIER -169.37 -104.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.795 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 133' ' ' HIS . . . . . 0.453 ' H ' ' HB3' ' B' ' 132' ' ' HIS . 0.8 OUTLIER -144.13 156.18 44.23 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 177.424 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -112.5 16.79 19.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.977 0.418 . . . . 0.0 110.272 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -132.99 90.57 2.77 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.087 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -92.64 40.18 1.05 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.328 0.585 . . . . 0.0 109.853 177.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 117.634 -1.174 . . . . 0.0 108.317 179.576 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 138' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 139' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.606 0.241 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -170.23 39.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.448 0.642 . . . . 0.0 109.909 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.434 ' HB2' ' HD2' ' B' ' 81' ' ' PRO . 1.4 mpp? -90.88 8.06 36.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.55 -177.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.774 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -59.65 -39.41 95.13 Favored Glycine 0 C--O 1.226 -0.395 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.748 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -39.47 91.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.045 0.45 . . . . 0.0 110.532 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.4 -55.78 29.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.106 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.918 ' HE2' ' HD3' ' B' ' 81' ' ' PRO . 3.0 p90 -78.97 -22.84 45.04 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.71 -176.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.575 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 18.6 t70 -54.31 -45.54 72.62 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.476 0.485 . . . . 0.0 110.613 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.05 91.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.945 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.94 -41.72 96.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.069 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.494 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.9 OUTLIER -58.76 -45.73 89.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.072 178.921 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -66.04 -27.85 68.41 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.694 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.46 -39.78 62.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -72.66 -49.06 34.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.693 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.817 HG11 ' HG2' ' B' ' 71' ' ' GLU . 1.4 t -64.14 -34.08 66.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.605 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -67.3 -30.85 70.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.588 0.232 . . . . 0.0 111.085 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.84 -25.56 67.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.006 0.432 . . . . 0.0 110.904 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.6 -29.89 63.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.103 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.35 -23.35 50.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.196 0.522 . . . . 0.0 110.836 174.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.82 -19.9 36.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.976 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.19 -21.9 66.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.155 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.607 ' HG3' ' HB2' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -138.24 -174.88 3.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.996 0.427 . . . . 0.0 111.621 -177.527 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.7 t -87.22 112.95 23.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.08 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.48 114.1 19.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.44 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -121.61 143.08 49.52 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 -177.25 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -73.97 140.14 77.07 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.893 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.407 ' HB3' ' HE3' ' A' ' 120' ' ' TRP . 2.0 Cg_endo -43.28 -36.27 6.11 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 124.232 3.288 . . . . 0.0 114.773 -175.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -41.26 61.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.927 0.394 . . . . 0.0 111.216 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -30.1 70.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.253 177.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.449 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.47 -45.69 52.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.604 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.737 ' HA ' HD12 ' A' ' 34' ' ' LEU . 60.4 t80 -63.38 -31.87 73.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.822 0.344 . . . . 0.0 111.097 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -56.87 -52.97 63.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.306 -178.649 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -70.4 -26.51 63.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.029 178.56 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.737 HD12 ' HA ' ' A' ' 31' ' ' TYR . 75.1 mt -64.34 -46.64 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.029 0.442 . . . . 0.0 111.008 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.726 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 1.2 pp0? -75.98 -29.51 58.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.572 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.63 -25.38 23.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -177.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -122.53 97.42 44.7 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.74 0.48 4.2 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.021 2.481 . . . . 0.0 112.818 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -95.43 -23.59 17.07 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 51.1 mt -80.07 112.38 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.172 173.015 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.732 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.2 OUTLIER -105.56 145.71 30.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.356 -174.192 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.984 HD11 ' HB2' ' A' ' 88' ' ' PHE . 4.3 tp -102.3 128.24 48.94 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -108.55 117.09 53.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 175.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.842 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.9 OUTLIER -105.4 138.13 42.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.224 -175.226 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.67 98.59 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.074 175.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.672 ' HD3' ' HG3' ' A' ' 117' ' ' MET . 0.2 OUTLIER -144.62 147.63 33.34 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.331 -176.881 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 1.362 ' CG ' HH11 ' B' ' 46' ' ' ARG . 70.5 m-20 -62.21 136.11 95.34 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 123.392 0.432 . . . . 0.0 111.086 -177.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -61.6 -31.38 86.94 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.07 2.514 . . . . 0.0 113.1 -177.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -78.37 -36.6 45.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.761 ' HB2' ' CG ' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -67.94 -34.53 76.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.36 175.355 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.615 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 tp -57.9 -34.59 69.98 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.418 0.628 . . . . 0.0 110.315 176.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -75.74 -39.1 57.77 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.763 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.88 -48.25 11.77 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 mtm -97.54 -36.61 10.25 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.595 -174.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.28 172.79 13.53 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.248 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.615 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -136.11 152.06 74.73 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -61.42 126.04 18.28 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.088 1.859 . . . . 0.0 112.769 -177.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.614 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 63.5 t0 -87.71 87.93 7.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.283 175.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.96 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -123.27 144.91 31.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.79 179.354 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.726 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.69 -42.14 71.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.036 -176.868 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.732 ' HB2' HG23 ' A' ' 41' ' ' THR . 7.3 p30 -114.47 72.97 0.8 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.25 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.96 ' HB2' HG23 ' A' ' 59' ' ' VAL . 7.5 t80 -97.47 117.91 32.78 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.474 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.62 ' HE2' HG21 ' A' ' 41' ' ' THR . 6.4 mtmm -117.97 110.83 18.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.962 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -83.5 116.3 22.48 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.937 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -117.82 93.66 4.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.997 0.427 . . . . 0.0 110.989 -174.653 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.75 -109.82 0.14 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.87 -0.604 . . . . 0.0 112.184 -174.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.861 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.2 OUTLIER 56.56 -135.07 1.24 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -171.279 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -90.45 -41.31 5.48 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 119.763 -1.208 . . . . 0.0 111.169 175.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.487 ' HD2' ' HG3' ' B' ' 94' ' ' ARG . 0.5 OUTLIER -157.16 44.13 0.36 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.656 0.265 . . . . 0.0 110.899 176.673 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.937 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 68.19 -12.76 0.31 Allowed 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 172.594 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.586 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -45.38 -56.52 9.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.888 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.861 ' HG2' ' HG2' ' A' ' 67' ' ' ARG . 11.5 Cg_exo -72.92 -18.32 24.53 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.898 1.732 . . . . 0.0 113.026 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.731 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 1.0 OUTLIER -90.44 -16.42 29.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.042 0.449 . . . . 0.0 110.384 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.645 HD13 HD11 ' A' ' 70' ' ' LEU . 42.1 tp -68.11 -35.87 78.84 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.134 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.42 -31.21 53.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.329 175.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.632 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 3.0 mttm -70.08 -25.09 63.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.912 -176.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.92 -44.74 13.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.946 0.403 . . . . 0.0 110.634 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.52 58.0 0.97 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.776 -0.726 . . . . 0.0 111.598 -176.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.609 ' HB3' ' HZ ' ' A' ' 107' ' ' PHE . 7.4 mt -91.6 145.02 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.604 0.24 . . . . 0.0 110.467 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -122.15 140.15 31.85 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -67.37 5.56 0.89 Allowed 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.881 2.388 . . . . 0.0 114.371 -173.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -101.85 -11.41 19.06 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.779 -0.575 . . . . 0.0 110.437 175.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.8 mptp? -87.9 119.96 70.66 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.257 -179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.675 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 12.5 Cg_exo -67.68 133.46 29.74 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.683 2.255 . . . . 0.0 111.086 176.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 3.8 m -136.19 155.57 35.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.047 0.451 . . . . 0.0 111.213 -177.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 p -124.68 141.86 43.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.269 176.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.822 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 3.6 m -107.95 143.34 18.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.984 ' HB2' HD11 ' A' ' 42' ' ' LEU . 5.7 t80 -123.21 139.2 54.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -174.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 4.6 t 84.31 90.94 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.416 1.086 . . . . 0.0 111.974 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.566 ' HA ' ' H ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -101.44 -25.06 14.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.494 178.783 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.639 ' HA ' ' HA2' ' B' ' 68' ' ' GLY . 0.0 OUTLIER -87.73 36.69 0.77 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -174.009 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -167.61 -77.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.938 0.399 . . . . 0.0 110.386 176.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.07 -26.6 60.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.76 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.612 HH12 HG13 ' A' ' 15' ' ' VAL . 0.0 OUTLIER 75.89 77.93 0.1 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.227 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.822 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . -58.13 -19.64 34.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.335 177.463 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.4 ' HB3' ' HD2' ' A' ' 94' ' ' ARG . . . -59.41 -34.64 72.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 177.792 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.21 -32.31 70.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.14 -38.14 61.13 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.644 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.41 -44.8 3.64 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.704 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -61.5 -24.85 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.8 0.333 . . . . 0.0 110.854 -174.844 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.0 -50.75 26.1 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-O 121.359 0.599 . . . . 0.0 110.713 175.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 102' ' ' LEU . 14.5 mt -55.05 -39.51 69.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.95 -173.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.49 -27.65 67.96 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.849 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 3.8 mt-10 -76.41 -7.78 55.76 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.024 0.44 . . . . 0.0 110.704 175.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.513 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 13.8 m-85 -103.65 -2.9 25.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.144 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 125.97 -12.15 7.28 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.232 -0.985 . . . . 0.0 113.685 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.609 ' HZ ' ' HB3' ' A' ' 79' ' ' LEU . 23.8 m-85 -59.44 111.8 1.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.082 0.467 . . . . 0.0 110.785 -177.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -66.97 -50.86 60.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.366 -171.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.675 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 1.8 m -121.54 101.99 7.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.195 0.522 . . . . 0.0 111.312 -174.675 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.3 tt -121.15 130.9 74.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.922 -176.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -112.77 141.76 46.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.591 -176.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.607 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 19.6 t-20 -113.09 144.21 43.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.576 ' OG ' ' HA ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -79.86 130.42 35.3 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -171.055 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -174.71 1.55 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.196 171.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.883 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 45.76 -104.14 0.06 OUTLIER Glycine 0 CA--C 1.518 0.249 0 O-C-N 123.413 0.445 . . . . 0.0 113.576 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.458 ' HA3' ' S4 ' ' A' ' 138' ' ' PS5 . . . -177.46 -163.11 28.84 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 177.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' MET . . . . . 0.672 ' HG3' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -71.93 -29.39 64.24 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.142 0.496 . . . . 0.0 109.978 176.939 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -33.56 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.87 178.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.924 ' HA ' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -66.95 -32.05 73.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.612 -179.006 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.689 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -61.54 -54.66 40.25 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 16.6 mt -63.55 -42.83 98.36 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.92 0.391 . . . . 0.0 111.207 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.924 ' HG2' ' HA ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -70.45 -32.86 70.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.932 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.492 ' N ' ' HG3' ' A' ' 122' ' ' GLU . 19.0 mm-40 -80.65 3.4 22.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -178.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.41 25.05 76.13 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.214 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.459 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 60.5 mt -74.24 161.7 77.12 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.614 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 35.3 Cg_endo -61.03 115.32 2.63 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.516 2.144 . . . . 0.0 111.385 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.24 150.39 51.94 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.513 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 5.7 mt -102.92 102.3 12.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.059 0.457 . . . . 0.0 110.154 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.95 127.23 45.63 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.07 44.92 0.33 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.116 -172.611 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 m 50.12 89.83 0.02 OUTLIER 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.318 0.647 . . . . 0.0 112.232 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -77.72 72.24 4.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.709 175.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -123.57 -14.31 7.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.704 -173.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -94.17 88.4 5.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.08 0.466 . . . . 0.0 110.259 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.46 81.69 0.2 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.493 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -67.19 -30.95 71.03 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 174.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 . . . . . 0 C--O 1.251 1.142 0 CA-C-O 117.46 -1.257 . . . . 0.0 108.092 175.133 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 120.92 0.391 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -150.02 117.27 6.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.467 176.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -115.76 19.2 15.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.755 175.46 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 4' ' ' GLY . . . . . 0.75 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.24 -44.57 96.37 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.689 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.98 -32.34 72.68 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.165 0.507 . . . . 0.0 110.888 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.576 ' HB2' ' HG3' ' B' ' 3' ' ' MET . 0.4 OUTLIER -71.55 -52.52 17.73 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.438 -174.491 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.75 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -83.81 -22.85 31.67 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.219 -176.185 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -53.24 -45.72 68.87 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.154 0.502 . . . . 0.0 109.989 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.26 -39.42 90.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.527 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.63 -46.74 62.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.451 0.167 . . . . 0.0 111.269 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' PHE . . . . . 0.513 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 0.4 OUTLIER -56.67 -43.17 80.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.411 0.624 . . . . 0.0 109.947 179.227 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 12' ' ' LYS . . . . . 0.597 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.7 OUTLIER -66.2 -26.39 67.37 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.486 176.544 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.89 -49.35 20.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.892 0.377 . . . . 0.0 111.124 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -62.91 -50.97 68.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.129 179.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.41 -32.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.596 -175.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.597 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 6.3 ttmm -66.03 -40.76 91.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.583 0.23 . . . . 0.0 110.913 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.66 -27.01 62.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.485 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.85 -32.54 63.71 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.753 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -24.95 41.2 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.462 0.648 . . . . 0.0 110.702 172.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.04 -17.11 36.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.026 -0.988 . . . . 0.0 112.317 -175.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.585 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 8.4 t0 -69.05 -25.96 64.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.901 -174.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.63 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 5.8 ptm -119.73 176.68 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.847 0.356 . . . . 0.0 111.772 -176.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 41.2 t -74.17 111.97 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.916 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.1 109.36 15.59 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.854 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' LEU . . . . . 0.497 ' HA ' HD23 ' B' ' 25' ' ' LEU . 0.9 OUTLIER -119.52 146.04 45.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.317 0.58 . . . . 0.0 111.02 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.38 137.81 52.05 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.289 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 3.4 Cg_endo -48.24 -22.35 3.78 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 124.05 3.167 . . . . 0.0 114.419 -176.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 16.7 mtmm -73.26 -42.47 62.46 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.165 -0.334 . . . . 0.0 110.906 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.26 -32.89 49.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.147 0.498 . . . . 0.0 110.225 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' B' ' 27' ' ' PRO . . . -63.48 -47.89 79.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.268 177.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' TYR . . . . . 0.639 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 78.8 t80 -66.82 -33.39 75.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 177.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' B' ' 35' ' ' GLN . 9.0 tptp -56.92 -50.22 73.23 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.115 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.525 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -72.18 -26.3 62.01 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.727 177.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' B' ' 31' ' ' TYR . 18.4 mt -63.45 -51.04 67.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.858 0.361 . . . . 0.0 111.183 178.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -71.22 -31.25 67.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.395 -177.304 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -82.06 -38.29 25.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.822 0.344 . . . . 0.0 111.765 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -110.04 108.54 59.06 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.909 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.33 0.1 7.89 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.671 2.248 . . . . 0.0 111.759 176.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.22 -29.65 14.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.071 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.568 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 61.2 mt -82.63 109.43 16.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.948 177.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -102.23 143.57 31.85 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.798 -177.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.931 HD11 ' HB2' ' B' ' 88' ' ' PHE . 5.8 tp -100.19 127.9 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 174.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.416 HG12 ' CE ' ' B' ' 65' ' ' MET . 2.0 mt -109.13 118.3 56.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-O 121.235 0.54 . . . . 0.0 109.669 177.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.768 ' HB3' ' CE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -104.64 133.32 49.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.528 -0.76 . . . . 0.0 108.951 178.378 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.866 HG11 HD22 ' B' ' 70' ' ' LEU . 27.6 m -131.61 99.52 3.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.034 -0.985 . . . . 0.0 109.974 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ARG . . . . . 1.362 HH11 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -153.93 165.27 36.64 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.614 -1.175 . . . . 0.0 109.36 -176.668 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 1.203 ' HB3' ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -66.51 129.86 94.13 Favored Pre-proline 0 C--N 1.316 -0.885 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.102 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 48' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' B' ' 52' ' ' LYS . 26.3 Cg_endo -68.72 -16.7 42.24 Favored 'Trans proline' 0 N--CA 1.474 0.349 0 C-N-CA 123.689 2.926 . . . . 0.0 114.843 -168.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.467 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . 0.4 OUTLIER -78.12 -46.62 20.19 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -173.531 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -71.2 -33.53 70.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 0.0 110.365 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.53 -44.39 97.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.338 175.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' B' ' 48' ' ' PRO . 1.7 ttpt -63.69 -37.08 86.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.747 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -97.46 -44.85 6.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -171.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 1.9 mmm -90.28 -34.8 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.405 -0.518 . . . . 0.0 112.33 -171.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' GLY . . . . . 0.491 ' HA2' ' O ' ' B' ' 128' ' ' LEU . . . 149.72 145.05 4.05 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.077 -1.059 . . . . 0.0 113.764 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' LYS . . . . . 0.439 ' HG3' ' HB2' ' B' ' 128' ' ' LEU . 0.0 OUTLIER -133.9 165.07 39.48 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 174.67 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.11 129.37 17.11 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.576 1.518 . . . . 0.0 112.559 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' ASP . . . . . 0.605 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 13.4 t70 -90.37 95.33 10.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.604 HG23 ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -138.27 153.14 26.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.598 -174.191 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -34.24 70.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.312 -176.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -132.53 79.39 1.85 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.31 0.576 . . . . 0.0 111.867 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' TYR . . . . . 0.768 ' CE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -139.08 137.62 36.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.482 176.287 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -120.7 129.09 53.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.944 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -90.29 111.74 23.04 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' MET . . . . . 0.553 ' HG2' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER -98.84 91.83 5.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.541 0.21 . . . . 0.0 110.516 -176.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.77 120.57 38.39 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.992 0.425 . . . . 0.0 111.543 -175.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 67' ' ' ARG . . . . . 0.502 ' HG2' ' CG ' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -155.55 -141.62 0.1 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 173.376 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 68' ' ' GLY . . . . . 0.639 ' HA2' ' HA ' ' A' ' 91' ' ' THR . . . -80.98 -42.26 9.75 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 119.322 -1.418 . . . . 0.0 109.641 169.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' LYS . . . . . 0.587 ' HE3' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -152.32 43.17 0.68 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.336 -0.932 . . . . 0.0 108.694 171.773 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.866 HD22 HG11 ' B' ' 45' ' ' VAL . 0.4 OUTLIER 55.76 2.95 0.08 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.165 1.386 . . . . 0.0 114.523 178.456 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.817 ' HG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -45.41 -63.97 1.05 Allowed Pre-proline 0 CA--C 1.547 0.837 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -174.417 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.573 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 61.8 Cg_endo -75.24 -12.78 21.05 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.349 2.033 . . . . 0.0 113.561 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.553 ' HB3' ' HG2' ' B' ' 65' ' ' MET . 0.1 OUTLIER -89.5 2.73 54.18 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.318 -0.239 . . . . 0.0 111.169 -174.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.95 HD21 HD21 ' B' ' 102' ' ' LEU . 8.7 tp -72.74 -52.86 13.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.344 -177.352 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -72.13 -19.68 61.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.733 0.302 . . . . 0.0 111.498 -177.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.65 -27.57 31.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.648 -175.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -77.95 -27.12 49.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -177.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.24 75.38 1.3 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.511 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 9.5 mt -129.59 145.23 51.5 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -128.03 138.47 33.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' PRO . . . . . 0.918 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 35.6 Cg_endo -69.21 12.48 0.28 Allowed 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.209 2.606 . . . . 0.0 114.245 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -102.77 -12.11 17.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 176.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 83' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -95.5 133.91 25.09 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.279 -177.274 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.568 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.7 Cg_exo -71.65 126.8 12.42 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.429 2.086 . . . . 0.0 110.839 175.241 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 6.3 m -132.11 151.88 35.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.534 -176.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 1.6 p -125.62 141.78 44.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' VAL . . . . . 0.825 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 16.6 m -107.73 141.03 23.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.931 ' HB2' HD11 ' B' ' 42' ' ' LEU . 8.9 t80 -119.12 141.48 48.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.034 -173.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 89' ' ' CYS . . . . . 0.589 ' HB2' ' O ' ' B' ' 88' ' ' PHE . 1.4 m 81.36 75.98 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.618 0.767 . . . . 0.0 111.754 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.574 ' HE3' ' HA ' ' B' ' 114' ' ' GLU . 0.0 OUTLIER -95.19 -23.66 17.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.191 -177.944 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.87 35.93 2.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -175.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -146.23 -88.67 0.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.318 176.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' B' ' 94' ' ' ARG . . . -74.64 -24.52 58.84 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.844 174.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 94' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' B' ' 93' ' ' ALA . 12.1 mmt180 80.72 83.8 0.04 OUTLIER 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.802 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.825 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -66.89 -10.57 50.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.151 -0.932 . . . . 0.0 110.625 175.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.52 -33.58 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.69 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.07 -29.75 70.14 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.602 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' ALA . . . . . 0.425 ' HB2' HD21 ' B' ' 70' ' ' LEU . . . -75.88 -56.04 5.05 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.293 0.568 . . . . 0.0 110.685 176.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 99' ' ' GLY . . . . . 0.42 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -71.74 -48.63 27.32 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.023 -0.99 . . . . 0.0 114.464 -171.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 100' ' ' LYS . . . . . 0.585 ' HB2' ' HB3' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -68.41 -33.71 74.72 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.497 -0.413 . . . . 0.0 111.107 -174.154 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 101' ' ' THR . . . . . 0.409 HG22 ' CE2' ' B' ' 105' ' ' TYR . 6.2 m -72.07 -36.01 69.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.656 0.265 . . . . 0.0 110.889 176.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 102' ' ' LEU . . . . . 0.95 HD21 HD21 ' B' ' 74' ' ' LEU . 8.9 mt -64.18 -47.75 78.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.446 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 103' ' ' ARG . . . . . 0.486 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.6 OUTLIER -65.1 -26.99 68.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.791 0.329 . . . . 0.0 110.597 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 2.9 mt-10 -73.11 -6.79 48.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.33 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 105' ' ' TYR . . . . . 0.409 ' CE2' HG22 ' B' ' 101' ' ' THR . 22.0 m-30 -106.07 -8.37 17.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.961 0.41 . . . . 0.0 110.284 175.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 109.28 60.92 0.52 Allowed Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.49 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' PHE . . . . . 0.66 ' CE1' HD22 ' B' ' 102' ' ' LEU . 1.3 m-85 -104.48 139.61 39.15 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 176.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 -77.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.498 0.499 . . . . 0.0 111.522 -175.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.503 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 2.7 m -129.94 109.05 10.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.141 0.495 . . . . 0.0 111.238 -178.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' ILE . . . . . 0.563 HG12 ' HE3' ' B' ' 22' ' ' MET . 2.3 tt -115.77 130.33 70.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.672 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -114.6 146.85 40.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.45 -177.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.63 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 7.0 t-20 -111.27 138.4 47.79 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 172.098 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.508 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 65.5 m -87.83 112.64 22.68 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.574 ' HA ' ' HE3' ' B' ' 90' ' ' LYS . 5.5 tp10 -62.06 145.76 52.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.966 176.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.75 -110.6 3.32 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.434 -0.889 . . . . 0.0 111.624 -174.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 116' ' ' GLY . . . . . 0.529 ' HA3' ' S3 ' ' B' ' 139' ' ' PS5 . . . 160.37 -162.5 33.35 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.88 -36.19 74.24 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.011 0.434 . . . . 0.0 110.699 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.607 ' HB3' ' S5 ' ' B' ' 139' ' ' PS5 . 3.5 t70 -61.85 -35.06 77.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.406 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 119' ' ' LYS . . . . . 0.539 ' O ' ' HG2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -74.01 -33.42 63.78 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.806 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.925 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 25.9 t-105 -57.6 -52.96 63.28 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.59 -39.84 95.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.024 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -70.67 -35.15 72.7 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 112.341 0.496 . . . . 0.0 112.341 -174.966 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 123' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 19.1 mm-40 -74.83 -4.24 36.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.813 0.34 . . . . 0.0 110.519 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.07 23.85 73.23 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.705 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.49 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 72.4 mt -76.67 160.78 76.25 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.49 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 29.5 Cg_endo -61.39 108.26 0.58 Allowed 'Trans proline' 0 C--O 1.236 0.397 0 C-N-CA 122.35 2.033 . . . . 0.0 111.221 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.71 156.01 43.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.714 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 128' ' ' LEU . . . . . 0.605 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 8.4 mt -110.55 100.66 9.43 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.897 0.38 . . . . 0.0 110.398 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -102.37 143.09 32.56 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 173.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.05 92.42 7.87 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 118.586 0.63 . . . . 0.0 109.319 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -38.47 112.4 0.23 Allowed 'General case' 0 C--N 1.33 -0.275 0 O-C-N 124.321 1.013 . . . . 0.0 112.474 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -113.62 87.71 2.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.14 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -98.41 -10.01 24.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.773 -178.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -72.91 -32.88 65.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.961 0.41 . . . . 0.0 110.179 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -76.39 68.31 2.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.29 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -79.87 -6.05 56.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.397 0.618 . . . . 0.0 109.543 175.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 . . . . . 0 C--O 1.248 1.012 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 171.715 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 138' ' ' PS5 . . . . . 0.458 ' S4 ' ' HA3' ' A' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 139' ' ' PS5 . . . . . 0.607 ' S5 ' ' HB3' ' B' ' 118' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -96.04 166.86 11.56 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 177.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -99.5 7.5 45.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.827 0.346 . . . . 0.0 111.304 -175.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.651 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -49.98 -23.45 5.48 Favored Glycine 0 CA--C 1.522 0.493 0 CA-C-N 115.127 -0.942 . . . . 0.0 114.061 -174.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -73.78 -32.68 63.9 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -64.07 -47.38 80.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -173.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.651 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.3 p90 -91.1 -23.19 20.38 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.967 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.654 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 2.9 t70 -53.59 -54.92 30.69 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.852 0.358 . . . . 0.0 110.629 -178.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.96 -42.24 89.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.526 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.518 ' HB ' ' CZ ' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -68.91 -44.98 72.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.41 -178.505 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.559 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.6 OUTLIER -57.93 -47.41 82.94 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.253 0.549 . . . . 0.0 110.074 -179.377 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.517 ' HD2' ' HD2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -64.76 -26.29 68.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.107 177.127 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.13 -40.78 64.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.883 0.373 . . . . 0.0 111.392 178.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -72.36 -49.88 30.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.793 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 t -62.07 -36.47 74.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.303 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HD2' ' HD2' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -64.14 -30.05 71.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.566 0.222 . . . . 0.0 111.49 179.558 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.02 68.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 110.687 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.439 ' HB1' ' HB1' ' A' ' 96' ' ' ALA . . . -73.62 -30.13 62.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.397 177.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -77.02 -24.15 52.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.528 0.68 . . . . 0.0 110.302 172.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.86 35.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.981 -1.008 . . . . 0.0 111.234 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -71.03 -24.21 62.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.787 -175.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.864 ' HE3' ' HA3' ' A' ' 99' ' ' GLY . 14.5 mtp -121.23 178.47 4.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.691 0.282 . . . . 0.0 111.158 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.7 112.45 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.541 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -78.28 103.19 8.06 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.174 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' A' ' 25' ' ' LEU . 3.2 mt -112.08 139.62 47.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.979 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.39 147.77 57.35 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.897 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.532 ' HB3' ' CE3' ' A' ' 120' ' ' TRP . 26.9 Cg_exo -34.18 -56.42 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.536 3.49 . . . . 0.0 114.394 -175.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.601 ' HG3' ' OE1' ' A' ' 123' ' ' GLU . 4.4 mttp -63.37 -37.82 88.76 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.069 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.51 -34.91 76.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 0.0 110.343 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.621 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -71.79 -47.37 53.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.518 176.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.597 ' HA ' HD12 ' A' ' 34' ' ' LEU . 82.6 t80 -60.02 -32.25 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.351 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.73 -51.87 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.438 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -74.31 -27.16 60.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.033 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 30' ' ' ALA . 81.6 mt -62.98 -55.35 26.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.989 0.423 . . . . 0.0 111.263 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.684 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -75.85 -22.27 56.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.071 -173.601 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.72 -24.29 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.883 0.373 . . . . 0.0 110.791 -177.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -129.49 94.11 33.54 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HA ' ' ND2' ' A' ' 61' ' ' ASN . 40.8 Cg_endo -68.81 9.58 0.44 Allowed 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.73 2.287 . . . . 0.0 113.103 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -91.12 -29.17 17.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.614 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 26.2 mt -83.16 100.91 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.458 173.092 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.66 HG21 ' HE2' ' A' ' 63' ' ' LYS . 9.9 m -92.61 146.8 23.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.401 -175.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.966 HD11 ' HB2' ' A' ' 88' ' ' PHE . 8.3 tp -100.74 128.3 46.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 173.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.418 HG23 ' SD ' ' A' ' 65' ' ' MET . 13.1 mt -109.59 118.15 56.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.442 177.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.852 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -102.39 124.02 47.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.225 0.536 . . . . 0.0 109.869 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -109.26 96.68 4.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.429 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.7 ' HA ' ' NE ' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -150.06 163.33 38.45 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.294 -176.32 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' A' ' 50' ' ' GLU . 6.0 t70 -75.91 137.28 69.6 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.786 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -59.6 -29.95 91.13 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.677 2.251 . . . . 0.0 112.367 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.23 -36.23 47.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.809 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.58 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -65.88 -35.79 81.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 173.251 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.865 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.0 OUTLIER -65.51 -33.67 76.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.734 177.232 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -42.08 61.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.648 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.06 -45.55 23.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -175.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.1 mtp -101.41 -34.7 9.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 116.41 179.14 18.05 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.56 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.865 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -148.23 155.7 43.09 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.108 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.475 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 23.4 Cg_endo -65.52 137.51 50.91 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.413 2.076 . . . . 0.0 112.598 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.69 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t0 -111.95 84.72 2.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.229 0.537 . . . . 0.0 110.595 178.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.776 HG22 ' HB2' ' A' ' 62' ' ' TYR . 13.0 m -112.02 163.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.005 176.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.684 ' HD2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.83 -42.94 72.53 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.634 0.584 . . . . 0.0 111.59 -177.546 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.409 ' ND2' ' HA ' ' A' ' 38' ' ' PRO . 27.6 p-10 -120.47 76.76 1.21 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.724 0.773 . . . . 0.0 111.206 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.852 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 2.4 t80 -116.99 125.97 52.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.431 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.66 ' HE2' HG21 ' A' ' 41' ' ' THR . 6.3 mttm -122.02 123.53 41.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.124 176.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.428 ' HB2' ' OH ' ' A' ' 62' ' ' TYR . 11.4 t-160 -94.64 132.93 38.85 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.628 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -107.42 150.84 26.3 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.66 178.174 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.451 ' HB2' ' HB3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -80.65 50.46 1.33 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -173.147 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.551 ' HD3' ' HA ' ' A' ' 47' ' ' ASP . 11.6 mtm180 61.2 -79.44 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 171.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -100.72 -3.44 55.05 Favored Glycine 0 CA--C 1.501 -0.842 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.3 OUTLIER -116.12 29.34 8.03 Favored 'General case' 0 N--CA 1.436 -1.125 0 CA-C-N 114.22 -0.99 . . . . 0.0 108.944 177.586 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.628 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER -66.51 -43.57 84.9 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 174.384 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.833 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.8 mp0 -49.05 -60.1 5.28 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.708 -177.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.833 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 13.8 Cg_exo -71.26 -18.09 30.54 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.248 1.966 . . . . 0.0 113.124 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.482 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -88.69 -15.45 34.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.616 0.246 . . . . 0.0 111.414 -178.434 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.872 HD21 HD21 ' A' ' 102' ' ' LEU . 3.3 tp -57.88 -52.8 63.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.239 0.543 . . . . 0.0 110.507 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.572 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -68.14 -29.4 68.29 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.651 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 1.6 mtpt -75.69 -30.39 59.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.072 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.9 m -78.85 -38.01 38.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.92 90.5 2.13 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.389 177.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.3 mt -134.23 148.54 50.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.848 0.356 . . . . 0.0 111.084 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.47 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -134.45 138.25 29.67 Favored Pre-proline 0 C--N 1.328 -0.331 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.358 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 44.4 Cg_exo -63.88 -1.06 3.07 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.368 2.712 . . . . 0.0 114.608 -172.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.414 ' O ' ' HD2' ' A' ' 108' ' ' LYS . 12.7 mm-40 -97.1 -5.88 36.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.039 0.447 . . . . 0.0 110.15 175.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -92.82 116.0 65.8 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.295 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.614 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 17.1 Cg_exo -63.27 141.44 82.1 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.436 2.09 . . . . 0.0 110.411 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.482 HG23 HD12 ' A' ' 110' ' ' ILE . 0.5 OUTLIER -138.58 146.28 26.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 121.091 0.472 . . . . 0.0 111.384 -175.246 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.512 HG13 HD12 ' A' ' 42' ' ' LEU . 1.5 p -119.91 142.9 33.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 172.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 5.3 m -102.85 127.43 56.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.038 0.447 . . . . 0.0 110.732 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.966 ' HB2' HD11 ' A' ' 42' ' ' LEU . 3.7 t80 -113.47 151.95 30.78 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.5 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' CYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 88' ' ' PHE . 5.4 p 179.36 -169.68 0.11 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.526 -176.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.447 ' HD2' ' HB3' ' A' ' 118' ' ' ASP . 0.3 OUTLIER -141.71 56.2 1.5 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.528 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.458 HG23 ' HA3' ' B' ' 68' ' ' GLY . 0.7 OUTLIER -175.87 -21.0 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.707 -174.35 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.576 ' HA ' ' S2 ' ' A' ' 138' ' ' PS5 . . . 74.53 -43.88 0.54 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.862 0.865 . . . . 0.0 112.618 177.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -55.07 -54.3 44.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.086 0.772 . . . . 0.0 113.086 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.47 -22.9 56.89 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.93 -176.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.24 -53.72 27.54 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 174.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.439 ' HB1' ' HB1' ' A' ' 18' ' ' ALA . . . -59.28 -36.75 76.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.132 176.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -67.17 -36.8 82.56 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.824 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ALA . . . . . 0.64 ' HA ' ' HZ ' ' B' ' 11' ' ' PHE . . . -74.47 -47.96 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.46 . . . . 0.0 110.644 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.864 ' HA3' ' HE3' ' A' ' 22' ' ' MET . . . -69.77 -52.99 17.38 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.666 -0.697 . . . . 0.0 113.626 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.39 -30.7 71.79 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.66 -0.318 . . . . 0.0 111.372 -175.21 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.449 HG22 ' CE2' ' A' ' 105' ' ' TYR . 47.3 m -73.05 -37.95 66.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.362 . . . . 0.0 110.846 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.872 HD21 HD21 ' A' ' 74' ' ' LEU . 12.8 mt -64.2 -46.11 85.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.153 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.37 -26.49 68.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 110.349 177.553 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -72.98 -9.21 58.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.491 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.449 ' CE2' HG22 ' A' ' 101' ' ' THR . 20.9 m-85 -106.03 -18.46 14.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 0.0 110.6 177.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 117.04 54.95 0.31 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.875 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.522 ' CE1' HD22 ' A' ' 102' ' ' LEU . 1.1 m-85 -94.47 167.92 11.2 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.711 -0.287 . . . . 0.0 110.261 176.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.456 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.4 tttt -77.17 -98.37 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.83 0.348 . . . . 0.0 111.303 -176.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.456 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -107.04 121.71 45.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.524 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.482 HD12 HG23 ' A' ' 85' ' ' VAL . 1.0 OUTLIER -121.91 126.77 74.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.49 0.662 . . . . 0.0 111.477 -174.775 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.47 147.53 44.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.254 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -117.71 144.78 44.94 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.5 131.3 36.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.473 0.654 . . . . 0.0 111.348 -172.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.409 ' HA ' ' OE1' ' A' ' 114' ' ' GLU . 3.8 tp10 -98.2 3.8 48.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.511 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.82 -92.9 2.28 Favored Glycine 0 N--CA 1.443 -0.84 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.203 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 89' ' ' CYS . . . 141.32 161.44 8.71 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' MET . . . . . 0.547 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -56.97 -41.38 78.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.115 0.457 . . . . 0.0 110.954 -176.97 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.447 ' HB3' ' HD2' ' A' ' 90' ' ' LYS . 9.5 p-10 -69.37 -27.61 65.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.424 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -72.65 -32.49 65.9 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.761 176.629 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.574 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 41.5 t-105 -56.99 -47.28 81.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.44 -38.22 86.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.753 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 119' ' ' LYS . 64.6 mt-10 -65.67 -37.3 86.12 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.558 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.601 ' OE1' ' HG3' ' A' ' 28' ' ' LYS . 15.5 mt-10 -83.58 4.08 29.81 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 70.48 28.8 70.61 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.344 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.482 HD21 ' HG2' ' A' ' 28' ' ' LYS . 71.7 mt -85.83 158.88 55.84 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-O 120.516 0.198 . . . . 0.0 110.513 -178.059 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.25 119.06 6.06 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.415 2.743 . . . . 0.0 112.564 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.4 m -133.19 158.31 43.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.032 0.444 . . . . 0.0 111.459 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.69 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 1.1 mt -113.97 111.31 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.295 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -142.47 150.76 40.96 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -86.64 70.59 10.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.99 0.424 . . . . 0.0 110.69 -177.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.06 -25.77 66.41 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.572 177.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.77 112.36 24.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.557 177.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -92.84 68.11 4.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.891 178.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -77.18 113.18 14.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.495 -175.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -156.8 116.98 3.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.955 176.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -113.06 158.33 20.47 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.491 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 1.4 t60 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.421 177.984 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.11 148.24 34.38 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' MET . . . . . 0.561 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mmm -90.03 3.65 52.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.469 -173.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' GLY . . . . . 0.698 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.45 -36.26 76.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.474 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.67 -32.29 73.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.857 0.361 . . . . 0.0 111.027 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -63.51 -48.12 78.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.994 -176.018 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.698 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.7 p90 -90.62 -22.46 21.2 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.192 -177.296 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ASP . . . . . 0.572 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -53.67 -47.43 70.41 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.986 0.422 . . . . 0.0 110.756 -177.153 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.9 -43.6 98.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.107 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.45 -42.57 92.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.522 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' PHE . . . . . 0.64 ' HZ ' ' HA ' ' A' ' 98' ' ' ALA . 0.2 OUTLIER -55.59 -50.41 70.16 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.006 0.431 . . . . 0.0 111.107 -176.797 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 12' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' B' ' 12' ' ' LYS . 20.9 tptt -69.68 -23.66 63.48 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.191 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.71 75.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -71.43 -50.14 34.78 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.229 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.73 -34.59 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.242 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -63.07 -31.97 73.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.529 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.32 -26.21 64.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 0.0 111.193 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.27 -45.6 83.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.702 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' B' ' 16' ' ' LYS . 1.1 ptmt -75.3 -21.01 58.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.099 0.476 . . . . 0.0 111.067 176.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -17.14 60.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.543 -178.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.4 -19.73 60.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.92 0.391 . . . . 0.0 111.554 -177.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.729 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 2.6 ptm -120.86 -179.54 4.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.758 0.313 . . . . 0.0 110.916 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.34 106.71 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.109 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.41 103.56 4.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.186 0.517 . . . . 0.0 110.267 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' LEU . . . . . 0.432 ' HA ' HD23 ' B' ' 25' ' ' LEU . 1.5 mt -116.0 141.35 48.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.885 -178.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.45 144.37 43.09 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.374 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.473 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 3.9 Cg_exo -40.68 -34.13 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 124.814 3.676 . . . . 0.0 115.402 -174.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.524 ' HE3' ' HB3' ' B' ' 123' ' ' GLU . 1.5 mttt -74.47 -44.04 53.38 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.672 0.669 . . . . 0.0 111.266 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.24 -33.38 75.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.247 0.546 . . . . 0.0 110.15 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.79 52.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.821 177.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' TYR . . . . . 0.557 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.6 t80 -63.96 -32.9 74.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.522 0.201 . . . . 0.0 111.037 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -54.59 -53.73 50.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.898 -179.741 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.461 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -74.78 -27.69 60.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.156 179.086 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.557 ' HB2' ' HA ' ' B' ' 31' ' ' TYR . 6.2 mt -62.45 -56.59 16.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.002 0.429 . . . . 0.0 111.418 -178.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -77.36 -21.71 52.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.222 -174.332 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -91.05 -27.94 18.28 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.578 -177.447 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -120.42 93.31 48.21 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' PRO . . . . . 0.511 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 31.5 Cg_exo -64.68 3.64 0.84 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 123.229 2.619 . . . . 0.0 114.067 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' B' ' 83' ' ' LYS . 20.4 t70 -92.18 -22.45 19.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.555 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 53.5 mt -78.31 107.66 10.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.751 174.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.534 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.6 OUTLIER -97.28 145.05 26.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.36 -175.95 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.886 HD11 ' HB2' ' B' ' 88' ' ' PHE . 11.1 tp -104.76 125.49 50.89 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.423 HD11 HD11 ' B' ' 79' ' ' LEU . 1.1 mp -102.33 116.61 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 175.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.754 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.72 121.5 41.76 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -176.445 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.738 HG12 ' HA ' ' B' ' 67' ' ' ARG . 0.0 OUTLIER -110.39 96.48 4.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ARG . . . . . 0.628 ' HA ' ' NE ' ' B' ' 46' ' ' ARG . 1.7 tpm_? -150.59 155.91 40.34 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.376 -175.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.434 ' HA ' ' HD3' ' B' ' 67' ' ' ARG . 1.0 OUTLIER -73.1 136.55 79.29 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.72 -177.898 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 -30.57 91.09 Favored 'Trans proline' 0 N--CA 1.466 -0.126 0 C-N-CA 122.742 2.294 . . . . 0.0 112.513 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -73.24 -42.88 62.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.949 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -33.2 75.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.181 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.737 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 tp -62.11 -33.87 75.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.629 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -70.2 -40.28 74.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.77 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.67 -41.49 13.34 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 3.1 mtp -97.65 -34.14 11.05 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.655 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 113.07 177.95 19.55 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.205 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' LYS . . . . . 0.737 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -147.24 160.72 38.81 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.468 ' HD2' ' HB2' ' B' ' 56' ' ' LYS . 11.9 Cg_endo -60.53 130.52 33.93 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.019 1.813 . . . . 0.0 112.887 -178.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' ASP . . . . . 0.419 ' HB2' ' C ' ' B' ' 127' ' ' SER . 48.0 t0 -92.34 97.69 11.03 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 173.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.647 HG23 ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -139.83 159.41 27.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.29 -175.879 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -28.29 36.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.255 -176.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.511 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 13.4 p-10 -130.02 69.98 1.44 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.342 0.591 . . . . 0.0 111.633 -174.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' TYR . . . . . 0.754 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -136.45 142.53 43.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.274 176.696 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.722 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 34.2 mttm -127.69 121.9 31.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 -177.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -76.93 129.23 35.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.529 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' MET . . . . . 0.871 ' HB3' ' HB2' ' B' ' 70' ' ' LEU . 14.6 mmt -100.14 142.1 32.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.721 174.341 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.9 43.58 0.51 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -174.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' ARG . . . . . 0.738 ' HA ' HG12 ' B' ' 45' ' ' VAL . 26.6 mtm180 63.43 -77.44 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.636 0.775 . . . . 0.0 112.465 174.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' GLY . . . . . 0.458 ' HA3' HG23 ' A' ' 91' ' ' THR . . . -99.14 -45.05 2.27 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 111.425 -0.67 . . . . 0.0 111.425 -179.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' LYS . . . . . 0.454 ' O ' ' HD2' ' B' ' 72' ' ' PRO . 2.9 mttt -83.34 39.32 0.65 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.051 0.453 . . . . 0.0 110.33 174.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.871 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -71.87 -37.66 70.16 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.645 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.606 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.89 -57.08 11.03 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.09 -175.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.486 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 9.6 Cg_exo -71.63 -17.67 29.57 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.21 1.94 . . . . 0.0 112.35 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.527 ' HA ' HD22 ' B' ' 73' ' ' LEU . 0.2 OUTLIER -80.51 -22.81 40.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.878 0.37 . . . . 0.0 110.131 177.348 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.916 HD21 HD21 ' B' ' 102' ' ' LEU . 4.6 tp -57.19 -52.02 66.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.31 177.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.654 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.441 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 76' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -71.46 -25.75 62.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.904 0.383 . . . . 0.0 111.019 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 77' ' ' SER . . . . . 0.722 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 47.7 m -78.19 -41.6 34.1 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.224 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.16 60.26 1.33 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.65 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.423 HD11 HD11 ' B' ' 43' ' ' ILE . 7.6 mt -94.72 151.15 19.51 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.0 OUTLIER -122.26 130.52 24.66 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 81' ' ' PRO . . . . . 0.437 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 59.5 Cg_exo -60.63 -6.95 6.39 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.697 2.931 . . . . 0.0 114.935 -171.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -90.6 -7.51 52.57 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.827 -0.545 . . . . 0.0 110.389 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 4.3 mttp -82.02 126.09 75.75 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.607 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.555 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 5.9 Cg_exo -72.24 122.16 8.13 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.192 1.928 . . . . 0.0 109.969 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 13.0 m -127.62 153.21 36.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.101 0.477 . . . . 0.0 111.565 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.406 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 1.4 p -124.28 143.05 39.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 176.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 m -106.43 122.94 60.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.8 0.333 . . . . 0.0 110.513 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.886 ' HB2' HD11 ' B' ' 42' ' ' LEU . 0.3 OUTLIER -91.69 123.58 35.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.852 -178.845 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 89' ' ' CYS . . . . . 0.562 ' O ' ' HB2' ' B' ' 90' ' ' LYS . 10.9 p -106.22 -165.26 1.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -168.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER 153.19 -22.72 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.854 1.662 . . . . 0.0 107.189 179.387 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 91' ' ' THR . . . . . 0.474 HG23 ' HB3' ' A' ' 67' ' ' ARG . 0.2 OUTLIER -105.17 25.95 9.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.79 174.462 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . 50.04 -103.57 0.13 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.658 -1.155 . . . . 0.0 113.327 176.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -54.74 -28.24 46.89 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -170.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 94' ' ' ARG . . . . . 0.428 ' O ' ' HD2' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -69.72 -31.37 69.32 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.939 -0.705 . . . . 0.0 112.383 -174.343 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.28 -47.86 66.56 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 174.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' B' ' 100' ' ' LYS . . . -59.57 -34.29 72.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.172 177.246 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -72.94 -35.23 66.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.811 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' ALA . . . . . 0.559 ' HA ' ' HZ ' ' A' ' 11' ' ' PHE . . . -71.4 -44.18 65.42 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.034 0.445 . . . . 0.0 110.561 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 99' ' ' GLY . . . . . 0.428 ' HA3' ' HE1' ' B' ' 22' ' ' MET . . . -76.02 -51.47 6.91 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.424 -177.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 100' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' B' ' 104' ' ' GLU . 0.0 OUTLIER -62.8 -31.77 72.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.907 0.353 . . . . 0.0 111.268 -174.791 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 101' ' ' THR . . . . . 0.5 HG22 ' CE2' ' B' ' 105' ' ' TYR . 10.8 m -73.03 -35.78 66.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.735 0.302 . . . . 0.0 110.98 175.089 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 102' ' ' LEU . . . . . 0.916 HD21 HD21 ' B' ' 74' ' ' LEU . 6.8 mt -62.65 -49.98 73.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.144 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 103' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -64.44 -27.01 68.7 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.874 0.368 . . . . 0.0 110.409 178.208 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' B' ' 100' ' ' LYS . 4.7 tt0 -71.14 -8.42 53.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.029 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 105' ' ' TYR . . . . . 0.518 ' CZ ' ' HB ' ' A' ' 10' ' ' THR . 21.4 m-30 -112.01 -8.09 14.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.778 0.323 . . . . 0.0 111.117 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.66 49.7 0.34 Allowed Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.127 -1.035 . . . . 0.0 112.98 174.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' PHE . . . . . 0.572 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.0 m-85 -99.43 149.26 23.38 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.125 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 108' ' ' LYS . . . . . 0.447 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -63.01 -91.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.42 -175.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.447 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.9 OUTLIER -116.36 122.25 44.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.34 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 110' ' ' ILE . . . . . 0.567 HG12 ' HE3' ' B' ' 22' ' ' MET . 1.2 tt -120.22 129.13 75.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.275 0.559 . . . . 0.0 111.285 -175.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 111' ' ' TYR . . . . . 0.406 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 1.2 m-85 -116.59 148.68 40.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.067 -177.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.729 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 10.3 t-20 -115.52 143.09 45.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.445 ' HB3' ' HA ' ' B' ' 88' ' ' PHE . 13.7 p -80.97 133.97 35.61 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.425 0.631 . . . . 0.0 111.511 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -86.18 123.34 31.35 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.507 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 115' ' ' GLY . . . . . 0.726 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 97.2 -79.29 0.67 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.673 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 116' ' ' GLY . . . . . 0.423 ' O ' ' HB2' ' B' ' 119' ' ' LYS . . . 150.27 -175.89 29.13 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.915 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 117' ' ' MET . . . . . 0.733 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -61.87 -27.47 68.81 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.933 0.493 . . . . 0.0 111.697 -176.61 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.425 ' O ' ' HG3' ' B' ' 122' ' ' GLU . 7.5 p-10 -67.85 -24.29 65.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 119' ' ' LYS . . . . . 0.726 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -72.18 -32.86 67.2 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.783 178.273 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.773 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 23.7 t-105 -55.57 -48.77 74.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.956 0.407 . . . . 0.0 109.973 176.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' B' ' 121' ' ' LEU . 0.8 OUTLIER -65.52 -37.76 87.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.756 176.297 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.445 ' HB2' ' HA ' ' B' ' 119' ' ' LYS . 21.0 mt-10 -67.9 -41.26 82.98 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -176.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 123' ' ' GLU . . . . . 0.68 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 3.9 mm-40 -74.02 -7.84 53.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.342 . . . . 0.0 110.992 -178.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.28 25.95 58.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.29 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.572 ' HG ' ' HB2' ' B' ' 123' ' ' GLU . 58.9 mt -80.44 159.97 68.57 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.56 0.219 . . . . 0.0 110.516 -178.112 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.525 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 18.5 Cg_endo -56.81 116.89 3.52 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.057 2.505 . . . . 0.0 112.121 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 127' ' ' SER . . . . . 0.419 ' C ' ' HB2' ' B' ' 58' ' ' ASP . 0.0 OUTLIER -126.86 149.18 49.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.461 -177.872 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.78 100.1 12.88 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.51 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.82 134.56 39.01 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.081 -173.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 9.5 ttm-85 -128.15 71.35 1.38 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.163 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -21.18 64.97 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.458 -174.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.32 109.9 20.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.824 0.345 . . . . 0.0 110.312 177.246 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -75.73 99.06 4.27 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.687 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 -67.58 103.96 1.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.221 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -171.57 111.68 0.32 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.562 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -139.38 170.21 16.35 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.633 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.556 -179.341 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 138' ' ' PS5 . . . . . 0.576 ' S2 ' ' HA ' ' A' ' 92' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 139' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -113.71 159.79 19.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.367 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.0 12.8 18.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.325 -178.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.763 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -55.7 -29.9 55.3 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.95 -177.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -39.81 79.58 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.799 0.333 . . . . 0.0 110.665 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -66.98 -58.45 4.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.562 -174.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.763 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 3.4 p90 -68.09 -25.32 65.27 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.975 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.25 -50.78 64.11 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.47 -45.34 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.787 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -47.53 77.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.796 0.331 . . . . 0.0 110.993 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.47 ' CD1' ' HB3' ' B' ' 71' ' ' GLU . 0.7 OUTLIER -57.12 -42.86 81.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.282 0.563 . . . . 0.0 109.787 179.027 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.24 -29.27 70.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.596 177.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.9 54.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.523 -178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -72.41 -49.38 34.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.027 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.767 HG22 HH21 ' A' ' 94' ' ' ARG . 3.0 t -60.51 -41.16 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -176.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -65.87 -27.6 68.34 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.65 -26.08 68.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.062 0.458 . . . . 0.0 111.099 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.15 -31.58 72.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.423 -178.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.502 ' HD2' ' SD ' ' A' ' 24' ' ' MET . 2.4 pttt -75.03 -20.18 59.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.908 0.385 . . . . 0.0 111.614 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -23.55 57.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.418 -177.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -85.61 4.56 35.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -175.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -145.56 162.77 36.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.65 0.262 . . . . 0.0 110.829 178.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 20.8 t -77.29 113.01 15.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.811 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.655 ' HE2' ' HB3' ' A' ' 112' ' ' ASN . 0.3 OUTLIER -79.26 112.99 17.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.487 179.733 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.62 145.28 49.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.086 0.469 . . . . 0.0 110.52 -178.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.36 141.45 36.92 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.168 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.11 -22.72 5.54 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 124.07 3.18 . . . . 0.0 114.997 -174.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.509 ' HA ' ' HD2' ' A' ' 28' ' ' LYS . 2.1 mmmm -73.65 -44.14 57.63 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.825 -0.547 . . . . 0.0 110.891 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.555 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 10.5 t0 -72.7 -37.29 67.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.853 176.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.48 -46.72 84.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.15 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.43 ' CE1' HG12 ' A' ' 59' ' ' VAL . 80.4 t80 -63.63 -42.8 98.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.804 -177.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -66.45 -41.54 88.97 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.813 -173.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 29' ' ' ASP . 0.3 OUTLIER -72.35 -27.38 62.38 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.598 176.082 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.611 HD11 ' HB2' ' A' ' 42' ' ' LEU . 1.9 mt -59.1 -50.56 73.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.767 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -76.26 -34.67 59.16 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.159 -177.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -70.47 -22.73 62.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.613 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -115.81 140.28 25.95 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-O 121.06 0.457 . . . . 0.0 111.659 -177.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.82 -9.4 10.93 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.778 2.318 . . . . 0.0 111.579 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.503 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -92.34 -67.02 0.88 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.299 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.753 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 52.3 mt -41.97 102.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.439 -175.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.797 HG21 ' HE2' ' A' ' 63' ' ' LYS . 26.4 m -101.85 145.09 29.68 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.271 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.991 HD11 ' HB2' ' A' ' 88' ' ' PHE . 18.1 tp -104.16 127.18 51.74 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.799 HD11 HD11 ' A' ' 79' ' ' LEU . 4.5 mt -106.69 114.57 46.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.087 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.784 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -100.41 135.78 41.31 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.627 -177.671 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -114.68 96.77 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 121.994 0.902 . . . . 0.0 109.809 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.682 ' HA ' ' NE ' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -143.4 142.52 31.27 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.611 177.468 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.499 ' HA ' ' NH2' ' A' ' 67' ' ' ARG . 5.9 m-20 -71.94 140.34 83.36 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -174.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -52.76 -27.41 34.02 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 123.585 2.857 . . . . 0.0 114.362 -168.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.684 ' HB3' ' HB3' ' B' ' 49' ' ' ASP . 0.7 OUTLIER -79.92 -31.62 40.11 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.903 178.403 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -36.92 72.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.982 0.42 . . . . 0.0 110.105 176.399 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.56 HD13 ' HB3' ' A' ' 46' ' ' ARG . 1.6 tp -60.65 -33.9 73.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.416 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.2 mttt -70.79 -38.59 73.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.261 177.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.83 -48.02 19.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.548 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 21.8 mmm -102.64 -34.02 9.23 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.556 -173.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 121.61 179.63 16.06 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.299 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.477 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -132.81 150.98 77.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.422 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 37.9 Cg_exo -62.34 134.91 50.93 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.514 2.143 . . . . 0.0 113.021 -176.316 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.475 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 26.9 t70 -101.26 92.35 4.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.699 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 62' ' ' TYR . 5.3 m -133.63 159.31 42.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.068 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -57.35 -41.42 80.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.303 -177.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.536 ' HB2' ' HA ' ' A' ' 41' ' ' THR . 0.1 OUTLIER -121.4 82.33 1.92 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.745 -177.305 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.784 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 3.2 t80 -120.31 125.94 49.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.797 ' HE2' HG21 ' A' ' 41' ' ' THR . 11.3 mttm -122.13 120.62 34.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.016 0.436 . . . . 0.0 110.123 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.425 ' HD2' ' O ' ' A' ' 44' ' ' ASP . 12.9 t-160 -88.24 128.32 35.46 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.233 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -126.56 171.97 10.64 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.075 0.465 . . . . 0.0 109.761 175.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.634 ' HA ' ' NH1' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -101.01 -176.77 3.26 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 174.041 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.634 ' NH1' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -93.31 -62.87 1.29 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.913 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.734 ' CA ' ' HB2' ' B' ' 94' ' ' ARG . . . -91.35 6.71 80.84 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.11 -0.567 . . . . 0.0 112.163 176.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.609 ' HB3' ' CB ' ' A' ' 66' ' ' SER . 1.1 tppp? -124.54 13.2 8.73 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.603 HD21 ' CZ ' ' B' ' 11' ' ' PHE . 0.0 OUTLIER -72.09 -32.29 66.87 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.191 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.863 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.1 mt-10 -47.35 -62.08 2.36 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.162 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.863 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 3.4 Cg_exo -75.12 -17.36 19.36 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.493 2.129 . . . . 0.0 113.711 178.063 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -90.0 -27.51 19.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -173.814 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.514 HD12 HD12 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -69.52 -28.84 66.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.23 0.538 . . . . 0.0 110.384 -177.557 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.433 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -76.91 -33.26 57.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.224 173.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . 0.651 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 11.4 mttt -62.69 -29.77 70.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.86 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -41.07 24.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.695 0.283 . . . . 0.0 110.874 -177.703 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.49 52.07 2.07 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.582 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.799 HD11 HD11 ' A' ' 43' ' ' ILE . 3.5 mt -75.81 143.58 41.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.407 0.146 . . . . 0.0 110.636 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.484 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -114.19 136.06 22.21 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.665 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 80' ' ' ASP . 25.6 Cg_exo -69.57 1.01 4.68 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.842 2.361 . . . . 0.0 114.06 -172.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.651 ' HA ' ' HD2' ' A' ' 108' ' ' LYS . 3.9 mt-10 -99.89 -7.1 25.7 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 121.996 -0.44 . . . . 0.0 110.715 178.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -84.19 118.65 71.77 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.277 177.485 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.753 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 8.4 Cg_exo -67.79 108.86 1.76 Allowed 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.45 2.1 . . . . 0.0 110.16 174.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.554 HG12 ' HB ' ' A' ' 41' ' ' THR . 9.0 m -114.64 154.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.292 0.568 . . . . 0.0 111.576 -172.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.536 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 1.5 p -123.85 142.56 40.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.264 177.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.856 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 6.0 m -108.46 126.09 65.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.991 ' HB2' HD11 ' A' ' 42' ' ' LEU . 3.7 t80 -100.83 126.21 47.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.947 -0.569 . . . . 0.0 112.062 -171.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' CYS . . . . . 0.776 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.1 OUTLIER 102.61 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 O-C-N 124.957 1.411 . . . . 0.0 110.934 179.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.457 ' HG2' ' H ' ' A' ' 115' ' ' GLY . 0.2 OUTLIER -100.31 -34.09 10.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.771 -177.717 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.503 ' HB ' ' S4 ' ' A' ' 138' ' ' PS5 . 0.2 OUTLIER -79.59 -77.66 0.18 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -175.695 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.97 -56.17 25.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.714 0.292 . . . . 0.0 111.651 -176.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.776 ' HB3' ' HB3' ' A' ' 89' ' ' CYS . . . -76.2 -49.58 16.8 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -177.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.767 HH21 HG22 ' A' ' 15' ' ' VAL . 0.0 OUTLIER 74.19 70.58 0.11 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.715 0.634 . . . . 0.0 110.69 -174.795 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.856 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . -69.06 -2.51 10.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.672 -178.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.95 -29.57 60.36 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.16 -34.49 71.01 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.829 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.89 61.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.915 0.388 . . . . 0.0 110.749 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.42 -53.23 3.91 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.945 -175.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.435 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -61.49 -33.39 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 122.545 -0.385 . . . . 0.0 111.763 -172.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.435 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 3.5 m -71.55 -36.39 70.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 110.921 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 102' ' ' LEU . 15.0 mt -69.92 -44.2 70.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.568 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.534 ' HA ' ' HB2' ' A' ' 107' ' ' PHE . 0.0 OUTLIER -63.91 -31.51 72.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.75 0.309 . . . . 0.0 110.735 -179.037 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.09 -5.22 50.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.262 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -103.41 -10.51 18.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.052 177.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.21 1.27 3.24 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 119.753 -1.213 . . . . 0.0 113.93 174.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.534 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 8.0 m-85 -67.69 136.82 54.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.212 0.506 . . . . 0.0 110.403 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.651 ' HD2' ' HA ' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -67.12 -81.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.715 -174.327 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.412 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -112.19 113.59 25.92 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.825 -177.106 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 0.7 OUTLIER -117.23 127.7 74.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.212 0.529 . . . . 0.0 110.479 -179.67 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.536 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 13.6 m-85 -112.69 145.0 41.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.996 -176.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.655 ' HB3' ' HE2' ' A' ' 24' ' ' MET . 9.5 t-20 -112.0 136.68 51.03 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.533 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 16.4 m -91.73 117.63 29.93 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -55.94 121.6 9.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.733 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.457 ' H ' ' HG2' ' A' ' 90' ' ' LYS . . . 86.84 -108.34 3.32 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.983 -177.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.559 ' HA3' ' S1 ' ' A' ' 138' ' ' PS5 . . . 159.06 -154.83 25.9 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.034 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' MET . . . . . 0.438 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 16.7 ttp -50.67 -33.65 23.44 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.844 0.457 . . . . 0.0 111.748 -177.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.53 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 27.0 t70 -58.43 -40.37 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.084 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -73.96 -31.94 63.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.632 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.726 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 22.5 t-105 -59.51 -53.86 53.27 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.23 -38.91 91.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.95 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -66.21 -44.8 82.84 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.707 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -81.78 20.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -175.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 65.66 24.8 71.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.251 -0.5 . . . . 0.0 113.153 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 120' ' ' TRP . 17.6 mt -83.44 152.05 63.37 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.852 0.358 . . . . 0.0 110.702 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.475 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 33.8 Cg_endo -66.01 118.71 5.73 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.79 2.326 . . . . 0.0 112.835 -176.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.76 149.84 42.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.434 175.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.403 ' CB ' ' HD2' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -102.61 124.9 48.99 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.514 -177.631 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -129.08 150.74 50.35 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.558 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -80.38 -30.12 37.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.014 0.435 . . . . 0.0 110.401 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.04 149.69 50.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.229 178.104 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 64.77 22.89 12.64 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.439 0.638 . . . . 0.0 110.423 -175.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -141.06 19.88 2.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.975 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 -135.68 36.33 2.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.396 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -90.8 61.13 4.66 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.064 0.459 . . . . 0.0 110.261 176.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -175.23 164.26 3.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.391 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.87 176.561 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.678 0.275 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -88.73 162.93 15.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.883 176.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.85 10.07 22.47 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -175.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' GLY . . . . . 0.612 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.14 -35.21 63.93 Favored Glycine 0 C--O 1.224 -0.476 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.921 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -33.61 58.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.841 0.353 . . . . 0.0 111.258 178.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -68.19 -56.46 8.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.612 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.9 OUTLIER -74.46 -22.27 59.18 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.583 -177.498 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 1.1 t70 -53.11 -50.1 65.15 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.819 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.21 -38.56 77.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.428 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -46.4 64.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 0.0 110.619 178.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 11' ' ' PHE . . . . . 0.603 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -56.01 -48.85 75.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.451 -179.158 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 12' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -62.47 -26.13 68.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.534 179.08 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.7 -44.4 56.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.068 0.461 . . . . 0.0 111.409 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.3 -49.83 31.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.902 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.9 t -64.09 -34.27 67.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.319 -175.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.621 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -64.02 -27.89 69.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.552 0.215 . . . . 0.0 111.345 178.747 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -25.57 68.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.94 0.4 . . . . 0.0 110.887 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.65 -32.5 64.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.882 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -78.15 -23.08 47.86 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.481 0.658 . . . . 0.0 110.366 171.939 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.58 -18.88 58.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.803 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -79.89 -2.29 42.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.282 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.548 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 1.0 OUTLIER -139.63 172.72 12.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 111.076 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 17.6 t -82.09 112.44 19.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.729 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' MET . . . . . 0.634 ' SD ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -72.7 100.47 2.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.764 -0.198 . . . . 0.0 110.524 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 25' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' B' ' 113' ' ' SER . 1.2 mt -117.68 134.2 55.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.146 0.498 . . . . 0.0 110.449 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.38 152.33 70.25 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.567 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 6.9 Cg_endo -51.72 -20.93 10.3 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 123.661 2.907 . . . . 0.0 114.701 -174.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.497 ' HA ' ' HD2' ' B' ' 28' ' ' LYS . 5.8 mmmm -75.44 -48.01 24.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.102 0.477 . . . . 0.0 110.975 176.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.81 -31.37 64.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.689 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.14 -43.92 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.63 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' TYR . . . . . 0.437 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 89.3 t80 -68.55 -31.7 71.11 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.065 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -53.7 55.15 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.054 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.513 HD13 HD13 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -74.46 -27.33 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.134 179.779 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.711 HD11 ' HB2' ' B' ' 42' ' ' LEU . 5.7 mt -57.74 -55.0 40.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.06 -177.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 35' ' ' GLN . . . . . 0.886 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 15.6 mm100 -74.59 -19.03 60.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.907 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -35.08 15.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.754 0.312 . . . . 0.0 111.478 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 1.2 m-80 -92.43 127.33 49.09 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -76.76 -9.55 18.33 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.632 2.221 . . . . 0.0 111.285 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' ASP . . . . . 0.422 ' CG ' ' HG3' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -90.99 -69.45 0.73 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 177.168 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.759 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 53.6 mt -44.11 109.75 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.833 -175.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.609 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -106.49 145.75 31.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.003 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.711 ' HB2' HD11 ' B' ' 34' ' ' LEU . 13.9 tp -102.44 124.41 47.97 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 96.4 mt -103.84 113.11 39.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.817 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.91 137.43 39.3 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.221 -177.434 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -115.34 97.19 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 121.87 0.843 . . . . 0.0 110.04 175.159 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ARG . . . . . 0.633 HH21 ' HB2' ' B' ' 93' ' ' ALA . 0.8 OUTLIER -148.41 134.29 19.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.423 177.715 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.405 ' HA ' ' NH2' ' B' ' 67' ' ' ARG . 0.1 OUTLIER -69.83 147.63 96.2 Favored Pre-proline 0 C--N 1.318 -0.78 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.056 -171.22 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -49.9 -32.74 31.14 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 124.055 3.17 . . . . 0.0 113.869 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.684 ' HB3' ' HB3' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -71.25 -43.05 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.724 0.297 . . . . 0.0 110.896 -179.407 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 50' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 8.0 mt-10 -67.27 -36.97 82.67 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.7 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.408 ' CD1' ' HB3' ' B' ' 46' ' ' ARG . 0.5 OUTLIER -61.8 -34.58 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.796 177.319 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -72.79 -41.43 64.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.928 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.02 -48.47 16.09 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -173.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -99.48 -35.63 9.82 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.628 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.62 -175.93 16.11 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.616 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.61 160.27 64.11 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.436 ' HB3' ' CZ2' ' B' ' 120' ' ' TRP . 25.5 Cg_exo -63.0 124.86 14.72 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.223 1.949 . . . . 0.0 112.913 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' ASP . . . . . 0.827 ' HB3' ' HB2' ' B' ' 126' ' ' PRO . 25.6 t70 -90.35 88.06 7.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.013 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.6 m -134.98 167.51 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' LYS . . . . . 0.886 ' HD2' ' HA ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -76.04 -27.84 57.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.929 0.395 . . . . 0.0 111.17 -176.88 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -122.65 68.77 0.97 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.458 -175.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' TYR . . . . . 0.817 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.3 t80 -121.79 127.49 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.816 0.341 . . . . 0.0 110.345 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.723 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 61.8 mttm -122.83 122.33 38.41 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 177.372 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -88.87 133.18 34.37 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 -177.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' MET . . . . . 0.536 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER -134.53 170.67 15.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.085 0.469 . . . . 0.0 110.796 179.319 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 66' ' ' SER . . . . . 0.417 ' HA ' ' NH1' ' B' ' 67' ' ' ARG . 0.7 OUTLIER -91.6 -177.33 4.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.509 174.765 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 67' ' ' ARG . . . . . 0.417 ' NH1' ' HA ' ' B' ' 66' ' ' SER . 0.0 OUTLIER -90.73 -46.86 7.99 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.418 -177.531 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 68' ' ' GLY . . . . . 0.515 ' CA ' ' HD3' ' A' ' 94' ' ' ARG . . . -100.3 -44.22 2.22 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 175.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 5.4 tttt -77.79 29.18 0.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.145 0.498 . . . . 0.0 110.432 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.735 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER -76.31 -47.01 25.1 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.691 177.722 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.735 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -54.38 -46.56 98.99 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -174.659 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.535 ' HD3' ' OE1' ' B' ' 71' ' ' GLU . 58.3 Cg_endo -71.18 -20.14 28.72 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.333 1.355 . . . . 0.0 111.921 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.536 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -86.33 -26.47 24.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.189 0.518 . . . . 0.0 110.015 177.404 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.943 HD21 HD21 ' B' ' 102' ' ' LEU . 4.6 tp -58.0 -52.75 64.21 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.958 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.69 -28.49 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.636 -175.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -91.75 -13.48 31.51 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.361 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 77' ' ' SER . . . . . 0.723 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 20.3 m -72.86 -27.67 62.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.897 0.38 . . . . 0.0 110.5 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' GLY . . . . . 0.42 ' O ' ' HE3' ' B' ' 63' ' ' LYS . . . 90.77 64.02 1.21 Allowed Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.433 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.2 mt -113.31 140.69 47.79 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.649 0.262 . . . . 0.0 110.406 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.87 ' HB3' ' HE3' ' B' ' 83' ' ' LYS . 3.3 t70 -114.55 133.03 22.58 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 81' ' ' PRO . . . . . 0.611 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 10.0 Cg_endo -57.6 -10.03 6.37 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.599 2.866 . . . . 0.0 115.266 -171.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.412 ' H ' ' HG3' ' B' ' 82' ' ' GLU . 0.0 OUTLIER -93.54 -10.53 34.52 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.679 -0.638 . . . . 0.0 110.924 179.825 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 83' ' ' LYS . . . . . 0.87 ' HE3' ' HB3' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -78.7 121.2 83.26 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.534 -177.407 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.759 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 4.8 Cg_exo -72.87 117.47 5.14 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.436 2.091 . . . . 0.0 109.984 173.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 12.3 m -121.1 158.24 23.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-O 121.313 0.578 . . . . 0.0 111.457 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.97 140.6 44.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' VAL . . . . . 0.955 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 1.8 m -110.84 122.48 65.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.122 0.487 . . . . 0.0 110.13 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.772 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -81.34 161.39 23.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.376 -175.993 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 89' ' ' CYS . . . . . 0.44 ' HB3' ' HB3' ' B' ' 93' ' ' ALA . 0.6 OUTLIER 65.98 88.34 0.11 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 171.751 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -100.99 -31.27 11.19 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 167.864 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 91' ' ' THR . . . . . 0.409 ' O ' ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -55.18 -52.09 64.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.337 -175.84 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.496 ' O ' ' HG2' ' A' ' 67' ' ' ARG . . . -103.56 -52.16 3.05 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.537 -178.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.633 ' HB2' HH21 ' B' ' 46' ' ' ARG . . . -76.62 -45.36 30.44 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -175.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' ARG . . . . . 0.734 ' HB2' ' CA ' ' A' ' 68' ' ' GLY . 5.6 ttp180 72.75 74.65 0.15 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.577 0.704 . . . . 0.0 110.482 -170.96 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.955 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -67.06 -1.15 3.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.213 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.03 -29.36 63.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.787 -176.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 97' ' ' LEU . . . . . 0.467 ' HA ' HD13 ' B' ' 97' ' ' LEU . 2.4 mm? -76.98 -31.33 56.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.819 0.343 . . . . 0.0 110.879 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.88 -35.1 62.31 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.025 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -94.7 -54.92 1.47 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.443 -0.884 . . . . 0.0 114.273 -174.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -28.44 67.87 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 122.399 -0.471 . . . . 0.0 111.981 -171.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.53 -35.83 70.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.892 0.377 . . . . 0.0 111.109 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 102' ' ' LEU . . . . . 0.943 HD21 HD21 ' B' ' 74' ' ' LEU . 15.4 mt -63.81 -46.61 84.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.751 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 103' ' ' ARG . . . . . 0.554 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.0 OUTLIER -66.02 -26.86 67.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.833 0.349 . . . . 0.0 110.725 -179.215 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.02 -6.16 36.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.219 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -110.56 -9.2 14.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.221 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 130.28 5.18 4.28 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.918 -1.134 . . . . 0.0 113.58 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' PHE . . . . . 0.611 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 5.9 m-85 -66.05 135.35 54.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.177 0.489 . . . . 0.0 110.276 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 6.3 mttt -61.24 -84.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.563 -174.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.35 119.13 35.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.095 0.474 . . . . 0.0 110.837 -178.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 110' ' ' ILE . . . . . 0.486 HG21 ' HG2' ' B' ' 103' ' ' ARG . 0.4 OUTLIER -117.34 128.38 74.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-O 121.177 0.513 . . . . 0.0 110.588 -178.192 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -115.41 146.56 41.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.121 -175.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.634 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 4.5 t-20 -114.47 141.9 47.09 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.508 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 14.6 m -86.9 105.58 17.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.25 0.548 . . . . 0.0 111.611 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 21.75 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.929 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -116.44 -66.44 0.38 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.182 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 123.53 170.48 13.4 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.444 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 117' ' ' MET . . . . . 0.526 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 1.0 OUTLIER -63.16 -34.71 78.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.021 0.439 . . . . 0.0 110.484 -179.549 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -62.1 -31.13 71.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.053 178.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 119' ' ' LYS . . . . . 0.567 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -72.81 -32.12 65.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.963 179.392 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.772 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.7 t-105 -60.21 -53.86 52.7 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 177.581 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' B' ' 121' ' ' LEU . 6.5 mt -63.93 -40.92 97.58 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -63.57 -43.85 95.82 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.885 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 123' ' ' GLU . . . . . 0.407 ' HB3' ' HD3' ' B' ' 28' ' ' LYS . 12.8 mm-40 -72.0 1.38 7.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.672 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.12 27.47 66.25 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.932 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 85.5 mt -82.66 150.99 64.0 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.827 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 13.5 Cg_endo -57.68 128.39 29.02 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 123.084 2.522 . . . . 0.0 112.547 -176.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.81 142.97 46.23 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.294 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.66 101.73 13.32 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -129.35 145.03 51.45 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.979 -174.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -67.2 -30.12 69.97 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 131' ' ' SER . . . . . 0.523 ' O ' ' HB2' ' B' ' 132' ' ' HIS . 0.7 OUTLIER -65.68 164.28 14.76 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.644 178.773 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 132' ' ' HIS . . . . . 0.523 ' HB2' ' O ' ' B' ' 131' ' ' SER . 22.1 m80 75.5 6.1 4.03 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.491 -172.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -133.14 -167.95 2.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.714 176.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 56.8 41.44 28.09 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.392 0.432 . . . . 0.0 111.178 176.089 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.12 -38.16 16.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.164 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 20.3 p-80 -111.25 132.54 54.27 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.076 176.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.369 -0.824 . . . . 0.0 109.504 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' PS5 . . . . . 0.559 ' S1 ' ' HA3' ' A' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 139' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.232 0 CA-C-O 121.277 0.561 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -149.5 52.88 0.94 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.819 0.818 . . . . 0.0 109.031 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -77.05 10.95 2.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.892 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.738 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -53.52 -32.76 46.41 Favored Glycine 0 C--O 1.226 -0.402 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.876 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.88 -32.55 74.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.994 0.425 . . . . 0.0 111.418 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.4 mmtm -69.79 -57.73 4.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.924 -175.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.738 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 4.9 p90 -77.79 -28.38 50.46 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.311 -0.556 . . . . 0.0 112.165 -174.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -45.0 71.11 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.006 0.431 . . . . 0.0 110.563 -177.732 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.63 -41.85 95.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.226 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -44.5 75.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.015 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -53.98 -46.84 71.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.264 0.554 . . . . 0.0 110.358 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.95 -26.53 65.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.466 178.235 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.86 -41.45 74.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.981 0.419 . . . . 0.0 110.602 177.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -71.32 -49.78 39.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.445 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.552 HG11 ' HG2' ' B' ' 71' ' ' GLU . 1.1 t -65.63 -35.77 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.951 -174.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.2 mttt -63.57 -30.2 71.35 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.803 0.335 . . . . 0.0 111.184 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.82 -26.37 68.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.145 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.55 -32.94 64.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.97 -178.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -78.42 -23.43 46.69 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.382 0.611 . . . . 0.0 110.582 172.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.01 -18.17 38.01 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.38 -22.26 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.889 -175.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.618 ' HE3' HG12 ' A' ' 110' ' ' ILE . 4.3 ptm -127.43 179.55 5.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.668 0.271 . . . . 0.0 111.018 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.5 t -80.14 108.24 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.471 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.13 121.6 25.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.944 0.402 . . . . 0.0 110.644 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 113' ' ' SER . 3.6 mt -134.73 143.61 47.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.065 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.98 141.88 75.48 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.888 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.652 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 5.8 Cg_endo -49.83 -22.92 7.84 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.825 3.017 . . . . 0.0 114.331 -175.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -45.83 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.076 -0.39 . . . . 0.0 110.642 174.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -68.32 -29.49 68.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.195 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.61 -46.06 49.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.779 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.608 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 66.5 t80 -66.26 -28.53 68.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 0.0 110.768 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -53.58 56.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.517 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -73.43 -27.39 61.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.711 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.625 HD11 ' HB2' ' A' ' 42' ' ' LEU . 1.1 mt -60.71 -55.25 35.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -74.0 -26.75 60.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.028 -176.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -79.08 -40.11 32.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.934 0.397 . . . . 0.0 110.584 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -118.78 100.51 50.97 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.669 -176.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -68.13 5.08 1.25 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.977 2.451 . . . . 0.0 112.394 178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.73 -33.12 23.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.552 174.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.689 HG12 ' HB2' ' A' ' 84' ' ' PRO . 13.9 mt -86.63 106.93 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.389 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.501 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -95.65 146.41 24.51 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.686 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.625 ' HB2' HD11 ' A' ' 34' ' ' LEU . 7.9 tp -98.45 127.62 44.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 83.1 mt -111.86 121.85 65.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.424 ' OD2' ' CE1' ' A' ' 64' ' ' HIS . 17.3 t70 -109.3 148.14 31.52 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.226 -179.022 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.39 98.82 5.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.542 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.413 ' HA ' ' HD2' ' A' ' 46' ' ' ARG . 8.5 mmm-85 -156.28 -170.81 3.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.669 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.43 ' HB3' ' HG3' ' A' ' 50' ' ' GLU . 3.9 t70 -100.02 129.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.843 0.354 . . . . 0.0 110.268 176.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.05 -19.34 65.91 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.684 2.256 . . . . 0.0 113.086 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -72.01 -51.26 22.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.779 0.324 . . . . 0.0 111.061 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HB3' ' CB ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -73.16 -27.6 61.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.338 177.137 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.98 -46.69 87.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.111 174.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -30.89 71.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.72 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.29 -48.3 11.38 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 36.6 mtm -92.24 -34.45 14.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -171.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 139.19 146.12 4.87 Favored Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.541 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.44 141.52 40.7 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 177.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.425 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 9.4 Cg_endo -56.98 121.9 10.88 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.547 2.165 . . . . 0.0 112.438 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -93.22 93.38 8.21 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.686 HG22 ' HB2' ' A' ' 62' ' ' TYR . 15.9 m -132.07 162.48 39.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.31 83.44 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.501 ' HB2' HG23 ' A' ' 41' ' ' THR . 19.4 p-10 -128.75 79.9 1.94 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.571 0.7 . . . . 0.0 111.286 -174.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.686 ' HB2' HG22 ' A' ' 59' ' ' VAL . 9.3 t80 -122.3 129.86 52.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.279 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.467 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 0.0 OUTLIER -125.07 122.39 37.06 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.183 0.516 . . . . 0.0 110.934 178.911 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.424 ' CE1' ' OD2' ' A' ' 44' ' ' ASP . 1.2 t60 -92.0 116.95 29.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.426 177.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.918 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -118.05 102.58 9.14 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.655 0.264 . . . . 0.0 110.791 -176.747 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.44 ' HB2' ' H ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -94.88 -103.37 0.15 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.976 -174.279 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.682 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.4 OUTLIER 56.6 -139.42 0.92 Allowed 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -173.188 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.669 ' HA2' HG22 ' B' ' 91' ' ' THR . . . -89.25 -44.27 5.06 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 119.599 -1.286 . . . . 0.0 110.574 174.005 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.538 ' HG2' ' HD2' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -151.73 45.04 0.77 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.785 -0.208 . . . . 0.0 110.849 174.863 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.918 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 68.43 -12.93 0.32 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 171.876 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.605 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -44.67 -58.5 5.22 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -173.443 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.682 ' HG2' ' HG2' ' A' ' 67' ' ' ARG . 13.3 Cg_exo -73.16 -16.95 25.01 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 122.079 1.853 . . . . 0.0 113.209 -175.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.741 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -96.46 -15.33 21.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.651 0.262 . . . . 0.0 110.685 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.736 HD13 HD11 ' A' ' 70' ' ' LEU . 30.6 tp -58.16 -54.95 41.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.168 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.76 -16.41 61.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.838 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -88.58 -17.9 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.467 ' HB2' ' HD2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -100.84 43.85 1.04 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.766 -175.664 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 43.47 64.7 1.73 Allowed Glycine 0 C--N 1.335 0.477 0 O-C-N 123.616 0.573 . . . . 0.0 113.459 175.667 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 74' ' ' LEU . 8.0 mt -116.32 128.64 55.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.131 0.491 . . . . 0.0 111.033 -177.591 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -129.82 149.93 74.44 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.809 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.36 17.75 0.28 Allowed 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.889 2.393 . . . . 0.0 113.59 -174.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.21 6.17 10.75 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.083 0.468 . . . . 0.0 110.179 176.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.1 mttm -106.88 133.8 20.12 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.689 ' HB2' HG12 ' A' ' 40' ' ' ILE . 2.5 Cg_endo -77.74 141.54 19.51 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.732 2.288 . . . . 0.0 110.721 175.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.521 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -143.93 148.32 18.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.834 0.349 . . . . 0.0 110.624 -177.595 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 p -123.86 140.05 48.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.981 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 13.3 m -108.57 134.72 49.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.345 -176.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.834 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.4 t80 -101.06 162.68 12.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.225 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' CYS . . . . . 0.548 ' HA ' ' HA2' ' A' ' 116' ' ' GLY . 0.1 OUTLIER 68.49 109.5 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 174.303 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.685 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -136.23 18.52 3.18 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.239 175.644 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.73 22.49 15.85 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -177.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -174.29 -66.07 0.01 OUTLIER 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.171 0.51 . . . . 0.0 110.438 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 94' ' ' ARG . . . -74.44 -45.89 43.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.589 179.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.788 ' HG3' ' HG2' ' B' ' 69' ' ' LYS . 0.0 OUTLIER 75.69 91.15 0.08 Allowed 'General case' 0 N--CA 1.465 0.276 0 O-C-N 124.096 0.873 . . . . 0.0 111.011 -179.809 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.981 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . -66.27 -2.87 4.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.941 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.84 -31.91 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.697 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.64 -33.69 76.21 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.616 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.18 -49.73 18.54 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.039 0.447 . . . . 0.0 110.913 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.422 ' HA3' ' CE ' ' A' ' 22' ' ' MET . . . -75.79 -51.69 6.93 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.46 -0.791 . . . . 0.0 114.127 -173.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -65.33 -30.57 71.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.914 0.387 . . . . 0.0 111.056 -174.282 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.482 HG22 ' CE2' ' A' ' 105' ' ' TYR . 32.7 m -72.16 -36.75 69.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.912 176.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.53 HD21 HD21 ' A' ' 74' ' ' LEU . 8.1 mt -68.05 -42.91 79.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.517 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 4.0 ptm180 -67.7 -27.24 66.66 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.849 0.357 . . . . 0.0 110.361 179.126 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.427 ' CD ' ' HZ1' ' A' ' 100' ' ' LYS . 0.5 OUTLIER -69.75 -6.91 35.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.361 174.644 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.522 ' CE1' ' HB ' ' B' ' 10' ' ' THR . 22.5 m-85 -107.4 -12.11 15.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.683 0.278 . . . . 0.0 110.762 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.46 50.98 0.73 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.323 173.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.459 ' CE1' HD22 ' A' ' 102' ' ' LEU . 2.0 m-85 -88.43 -179.84 6.17 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.679 -0.307 . . . . 0.0 110.584 177.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -85.46 -97.02 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.655 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.19 115.91 29.59 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.742 0.305 . . . . 0.0 110.554 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.618 HG12 ' HE3' ' A' ' 22' ' ' MET . 1.5 tt -118.05 127.72 75.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.068 0.461 . . . . 0.0 110.743 -176.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -115.62 144.95 43.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.625 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.582 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 4.1 t-20 -107.87 136.14 48.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 171.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.479 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.1 m -88.45 108.76 19.55 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.704 0.287 . . . . 0.0 111.759 -175.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -58.89 135.59 57.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.296 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.621 ' O ' ' HG3' ' A' ' 90' ' ' LYS . . . 93.1 -106.88 3.47 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.75 -174.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.584 ' H ' ' HB2' ' A' ' 119' ' ' LYS . . . 160.79 -156.97 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' MET . . . . . 0.472 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 2.2 ttm -59.02 -33.68 71.02 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.203 0.525 . . . . 0.0 109.987 177.294 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.496 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.8 OUTLIER -61.73 -32.28 72.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.014 177.205 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.652 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -74.6 -32.75 62.46 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 122.168 0.187 . . . . 0.0 111.476 178.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.834 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 24.8 t-105 -59.83 -53.32 59.35 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 121' ' ' LEU . 5.5 mt -64.84 -38.94 92.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.967 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.7 OUTLIER -65.51 -35.77 81.85 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.873 0.368 . . . . 0.0 111.483 -178.294 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.722 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.0 tp10 -79.43 -3.89 48.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.3 29.18 68.74 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 121.056 -0.593 . . . . 0.0 112.041 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.722 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 52.3 mt -80.94 160.65 65.69 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-O 120.679 0.276 . . . . 0.0 110.879 -176.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 21.0 Cg_endo -58.47 117.58 4.32 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.079 2.519 . . . . 0.0 112.47 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.4 m -128.44 146.39 50.82 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.2 mt -99.36 103.1 14.88 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.077 0.465 . . . . 0.0 110.105 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -115.7 142.21 47.05 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.676 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.66 79.08 2.21 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 176.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.83 113.86 1.02 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.965 -1.016 . . . . 0.0 112.646 -170.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.69 86.66 3.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 173.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.9 -8.83 57.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.661 -173.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -67.69 -29.45 68.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.747 0.308 . . . . 0.0 110.775 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -78.54 80.13 4.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.183 0.516 . . . . 0.0 111.443 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 50.1 p-80 -86.26 -20.04 29.05 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.63 171.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 46.9 t60 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.153 -1.403 . . . . 0.0 107.327 176.826 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.406 0.622 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -138.24 65.29 1.47 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.362 -176.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' MET . . . . . 0.552 ' HG3' ' HG3' ' B' ' 6' ' ' LYS . 1.9 mpp? -78.82 2.88 18.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.279 -175.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' GLY . . . . . 0.715 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.31 -39.24 81.9 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.633 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -63.48 -33.04 74.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.299 -0.451 . . . . 0.0 111.421 176.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.552 ' HG3' ' HG3' ' B' ' 3' ' ' MET . 1.7 mmmt -71.27 -52.24 20.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.626 -175.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.715 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 2.2 p90 -82.41 -24.31 34.44 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.267 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.92 -49.49 65.87 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.777 0.322 . . . . 0.0 110.683 -179.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.67 -44.71 77.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.255 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' THR . . . . . 0.522 ' HB ' ' CE1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -64.89 -42.86 94.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.938 179.132 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 11' ' ' PHE . . . . . 0.468 ' O ' ' HB ' ' B' ' 15' ' ' VAL . 0.5 OUTLIER -57.85 -47.96 81.17 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.013 0.435 . . . . 0.0 110.428 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 12' ' ' LYS . . . . . 0.607 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.41 -25.9 68.22 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.185 177.597 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.21 -47.53 27.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.101 0.477 . . . . 0.0 111.262 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.89 -50.37 35.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.688 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.505 HG13 HH22 ' B' ' 94' ' ' ARG . 0.5 OUTLIER -60.2 -33.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.633 -176.791 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.607 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.1 OUTLIER -70.8 -38.9 73.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.594 0.235 . . . . 0.0 110.978 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.08 -25.82 64.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.493 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.34 81.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.683 -179.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' B' ' 16' ' ' LYS . 4.9 pttp -77.62 -22.0 51.44 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.293 0.568 . . . . 0.0 110.865 174.293 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.79 -19.48 52.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.54 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 25.4 t70 -69.18 -25.84 64.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.751 -175.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.434 ' CE ' ' HA3' ' B' ' 99' ' ' GLY . 12.4 ptm -117.49 179.87 3.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.814 0.34 . . . . 0.0 111.708 -177.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 34.8 t -76.61 113.64 15.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.527 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.04 112.67 21.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.896 -177.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' B' ' 25' ' ' LEU . 4.1 mt -112.39 -169.09 1.41 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.02 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.69 144.65 47.11 Favored Pre-proline 0 C--N 1.317 -0.848 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 173.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.0 -25.14 11.92 Favored 'Trans proline' 0 CA--C 1.531 0.335 0 C-N-CA 123.554 2.836 . . . . 0.0 113.581 -176.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -43.22 59.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.969 0.414 . . . . 0.0 110.72 176.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ASP . . . . . 0.464 ' HB3' HD13 ' B' ' 25' ' ' LEU . 0.2 OUTLIER -73.89 -32.97 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.95 178.462 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.617 ' HB1' HG21 ' B' ' 86' ' ' VAL . . . -66.69 -47.33 72.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.734 178.221 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' TYR . . . . . 0.618 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 71.5 t80 -67.92 -30.53 69.87 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.811 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -55.73 -53.1 60.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.946 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.2 OUTLIER -74.36 -27.05 60.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.813 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.7 HD11 ' HB2' ' B' ' 42' ' ' LEU . 2.9 mt -60.46 -55.9 27.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.024 0.44 . . . . 0.0 111.797 -178.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -76.03 -19.12 58.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.103 -0.499 . . . . 0.0 112.02 -173.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -16.72 18.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.486 -178.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.571 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 10.6 m-80 -121.32 101.24 44.22 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -66.2 -5.51 12.61 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 123.161 2.574 . . . . 0.0 113.416 -176.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' ASP . . . . . 0.422 ' CG ' ' HZ2' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -98.28 -19.67 17.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.745 0.307 . . . . 0.0 110.84 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.628 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 26.5 mt -82.68 105.24 12.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.926 176.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.672 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -98.72 145.18 27.17 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.05 -176.615 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.957 HD11 ' HB2' ' B' ' 88' ' ' PHE . 12.7 tp -100.91 125.18 47.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 2.0 mt -105.55 115.57 47.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.757 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -101.26 133.66 45.5 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.421 ' O ' ' HB3' ' B' ' 93' ' ' ALA . 0.1 OUTLIER -126.78 98.96 5.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.599 -179.693 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -160.16 154.93 24.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.314 -174.252 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' B' ' 46' ' ' ARG . 0.0 OUTLIER -59.74 144.89 84.75 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 120.986 0.422 . . . . 0.0 111.241 -178.835 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.06 -18.54 35.55 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 123.322 2.681 . . . . 0.0 114.01 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.49 ' CB ' ' HB3' ' A' ' 50' ' ' GLU . 1.0 OUTLIER -74.89 -42.65 57.42 Favored 'General case' 0 CA--C 1.51 -0.568 0 O-C-N 121.867 -0.521 . . . . 0.0 111.296 -178.052 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -66.53 -35.09 79.39 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.799 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.4 mp -56.68 -34.17 67.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.417 176.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -79.31 -41.13 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.032 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.24 -48.06 13.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.476 -172.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -97.7 -34.32 10.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.755 0.312 . . . . 0.0 110.795 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 176.42 14.94 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.009 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' LYS . . . . . 0.799 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.1 OUTLIER -134.67 151.33 75.68 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.054 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -57.18 125.96 20.6 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.762 2.308 . . . . 0.0 112.671 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' ASP . . . . . 0.808 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 7.4 t0 -100.37 91.47 4.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.335 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.521 HG23 ' H ' ' B' ' 61' ' ' ASN . 2.8 m -128.49 166.39 25.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 176.298 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -29.14 67.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.824 0.345 . . . . 0.0 111.239 -176.177 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.588 ' HB2' HG23 ' B' ' 41' ' ' THR . 5.1 p30 -131.22 77.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.261 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' TYR . . . . . 0.757 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.6 OUTLIER -130.42 141.01 50.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.961 178.165 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.672 ' HE2' HG21 ' B' ' 41' ' ' THR . 0.0 OUTLIER -135.31 135.41 40.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.86 0.362 . . . . 0.0 110.675 175.65 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -88.69 118.64 28.51 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' MET . . . . . 0.467 ' HB3' ' HB2' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -109.08 91.49 3.66 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.328 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.9 77.32 1.08 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.061 0.458 . . . . 0.0 111.609 -173.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 67' ' ' ARG . . . . . 0.858 ' HG2' ' HG2' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -105.5 -136.47 0.35 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.765 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -81.45 -44.11 8.13 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 119.145 -1.502 . . . . 0.0 109.68 169.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' LYS . . . . . 0.904 ' HE3' ' HA ' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -146.7 44.8 1.19 Allowed 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.553 -0.823 . . . . 0.0 108.996 171.001 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.535 HD12 HD13 ' B' ' 74' ' ' LEU . 0.5 OUTLIER 55.73 0.42 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.162 1.385 . . . . 0.0 114.432 177.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.694 ' HB2' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -45.94 -66.1 0.56 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -174.46 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.858 ' HG2' ' HG2' ' B' ' 67' ' ' ARG . 55.3 Cg_endo -74.43 -15.13 22.42 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 121.99 1.794 . . . . 0.0 113.79 -177.128 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.477 HD22 ' HA ' ' B' ' 73' ' ' LEU . 0.1 OUTLIER -83.04 -15.11 52.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.218 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.964 HD21 HD21 ' B' ' 102' ' ' LEU . 9.0 tp -58.51 -53.84 53.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.975 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.09 -24.94 65.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.73 -25.98 49.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.745 -175.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -106.31 43.99 1.09 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -173.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.75 77.77 0.09 OUTLIER Glycine 0 C--N 1.336 0.566 0 N-CA-C 114.495 0.558 . . . . 0.0 114.495 172.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.426 HD21 ' HE3' ' B' ' 63' ' ' LYS . 53.3 mt -127.59 136.19 51.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.711 0.255 . . . . 0.0 110.697 177.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.475 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 3.5 t0 -135.47 136.63 24.43 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.624 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 81' ' ' PRO . . . . . 0.562 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 32.9 Cg_exo -63.35 11.82 0.09 OUTLIER 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 123.542 2.828 . . . . 0.0 114.828 -173.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.95 -8.53 17.57 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 121.778 -0.576 . . . . 0.0 110.492 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 83' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.8 mttp -90.93 134.18 30.75 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.751 -176.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.628 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 1.3 Cg_endo -78.6 121.82 5.28 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.756 2.304 . . . . 0.0 110.198 171.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.531 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.1 OUTLIER -127.23 151.68 34.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 120.959 0.409 . . . . 0.0 111.177 -174.876 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.617 HG21 ' HB1' ' B' ' 30' ' ' ALA . 1.4 p -125.18 140.19 48.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.013 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 87' ' ' VAL . . . . . 0.934 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 16.6 m -108.25 137.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.342 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.957 ' HB2' HD11 ' B' ' 42' ' ' LEU . 8.3 t80 -120.19 143.9 47.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.575 -175.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 89' ' ' CYS . . . . . 0.403 ' SG ' ' HB2' ' B' ' 46' ' ' ARG . 0.1 OUTLIER 78.12 76.41 0.06 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.824 0.703 . . . . 0.0 111.31 -177.636 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.669 ' HA ' ' H ' ' B' ' 95' ' ' ALA . 0.3 OUTLIER -89.43 11.74 18.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.698 -179.275 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 91' ' ' THR . . . . . 0.669 HG22 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -98.62 -88.67 0.32 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -174.817 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -50.92 -72.65 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -175.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' B' ' 45' ' ' VAL . . . -75.28 -27.25 59.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.671 0.272 . . . . 0.0 110.488 178.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 94' ' ' ARG . . . . . 0.538 ' HD2' ' HG2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER 71.61 85.91 0.12 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.45 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.934 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -61.22 -12.89 14.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.995 179.121 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.05 -32.19 69.54 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.101 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -73.44 -26.94 61.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.858 0.361 . . . . 0.0 110.633 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.65 -44.63 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.007 0.432 . . . . 0.0 110.691 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 99' ' ' GLY . . . . . 0.434 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -85.32 -45.46 5.86 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.637 -0.792 . . . . 0.0 114.061 -173.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 100' ' ' LYS . . . . . 0.482 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -64.71 -34.77 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.99 0.424 . . . . 0.0 111.19 -174.906 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 101' ' ' THR . . . . . 0.482 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 3.9 m -72.56 -35.43 67.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.179 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 102' ' ' LEU . . . . . 0.964 HD21 HD21 ' B' ' 74' ' ' LEU . 8.1 mt -67.04 -42.98 83.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -177.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 103' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -65.45 -26.59 68.02 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.08 0.467 . . . . 0.0 110.211 178.5 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.02 -7.38 48.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.701 177.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 105' ' ' TYR . . . . . 0.428 ' CE2' HG22 ' B' ' 101' ' ' THR . 22.4 m-85 -108.21 -17.55 13.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.634 0.254 . . . . 0.0 110.876 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.73 29.05 1.46 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 119.987 -1.101 . . . . 0.0 113.351 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' PHE . . . . . 0.513 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.7 m-85 -74.36 154.97 38.62 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 108' ' ' LYS . . . . . 0.443 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -66.75 -92.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.065 0.459 . . . . 0.0 111.278 -174.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.443 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.2 OUTLIER -115.28 110.89 20.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.27 -178.935 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 110' ' ' ILE . . . . . 0.531 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.3 tt -112.23 128.58 68.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.035 0.445 . . . . 0.0 110.49 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -117.77 148.13 42.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.734 -174.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -116.77 141.58 48.02 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 16.1 m -91.1 107.44 19.2 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -175.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.48 158.13 34.45 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.021 0.438 . . . . 0.0 110.748 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 90.74 -78.71 1.43 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.76 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 116' ' ' GLY . . . . . 0.497 ' HA3' ' S5 ' ' B' ' 139' ' ' PS5 . . . 142.27 -170.12 25.14 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.164 178.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 117' ' ' MET . . . . . 0.597 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 4.0 tpp -66.11 -30.28 70.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 110.32 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.28 -32.28 71.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.971 179.549 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 119' ' ' LYS . . . . . 0.407 ' HD2' ' OD1' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -69.64 -32.61 71.39 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.788 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 18.2 t-105 -60.23 -54.86 40.71 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.256 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 7.1 mt -66.95 -39.39 87.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.127 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.568 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.9 OUTLIER -63.69 -43.41 96.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.799 -176.885 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 123' ' ' GLU . . . . . 0.474 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 3.1 tp10 -75.7 -2.95 31.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.25 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.35 30.4 60.6 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.799 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.474 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 52.2 mt -76.64 157.7 81.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.532 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 25.2 Cg_endo -61.52 120.54 8.24 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.849 2.366 . . . . 0.0 112.25 -177.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.22 144.54 38.52 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 128' ' ' LEU . . . . . 0.808 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 19.8 mt -93.6 101.32 13.48 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 176.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.0 137.17 54.25 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.766 -176.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.75 78.16 4.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 174.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.5 m -36.31 120.11 0.64 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.154 -1.385 . . . . 0.0 112.606 -171.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -72.56 55.19 0.35 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.905 -173.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -89.38 44.79 1.23 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.09 0.472 . . . . 0.0 110.417 177.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -124.85 22.31 8.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.129 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -110.58 98.47 7.65 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.153 0.502 . . . . 0.0 110.357 177.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -78.33 -22.92 47.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.141 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 3.1 t60 . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.05 -0.976 . . . . 0.0 109.4 176.82 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 138' ' ' PS5 . . . . . 0.405 ' S3 ' ' HB3' ' A' ' 117' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 139' ' ' PS5 . . . . . 0.497 ' S5 ' ' HA3' ' B' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.666 0.27 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -151.88 5.55 0.43 Allowed 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -178.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.59 7.99 2.62 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.858 0.361 . . . . 0.0 111.668 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.794 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -50.45 -24.97 7.94 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.513 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.7 -31.91 68.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.901 0.381 . . . . 0.0 111.218 177.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -64.98 -57.24 9.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.098 -175.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.794 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.2 p90 -76.28 -21.23 56.53 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.391 -176.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.602 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 0.7 OUTLIER -52.44 -49.81 63.85 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.348 0.405 . . . . 0.0 110.301 -178.328 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.81 85.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.458 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.5 -45.3 80.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.267 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.516 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.9 OUTLIER -58.97 -47.28 85.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.147 0.498 . . . . 0.0 110.277 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -64.91 -26.64 68.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.289 178.024 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -41.89 61.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.0 0.428 . . . . 0.0 111.618 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -71.09 -49.82 40.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.625 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.3 t -63.01 -34.86 68.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.379 -177.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -68.86 -35.21 76.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.646 0.26 . . . . 0.0 111.25 178.524 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.99 -26.06 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.643 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.0 -35.66 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.501 ' HA ' ' SD ' ' A' ' 22' ' ' MET . 0.8 OUTLIER -74.64 -19.23 60.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.658 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.24 -24.81 59.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.474 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.401 ' O ' ' HD3' ' A' ' 103' ' ' ARG . 8.8 t70 -87.47 17.86 4.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.915 0.388 . . . . 0.0 111.943 -175.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.501 ' SD ' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -144.79 165.2 28.76 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.121 -0.362 . . . . 0.0 111.462 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.1 t -84.03 104.51 12.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.544 174.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.649 ' HB3' ' HG2' ' A' ' 114' ' ' GLU . 0.7 OUTLIER -82.6 114.05 20.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.212 0.529 . . . . 0.0 110.85 -175.267 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.469 ' HA ' HD23 ' A' ' 25' ' ' LEU . 3.3 mt -122.98 147.05 47.07 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.252 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.6 142.9 78.1 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.177 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.741 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 4.9 Cg_endo -47.59 -31.05 13.31 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.551 2.834 . . . . 0.0 113.553 -178.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -74.05 -41.5 61.66 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 122.188 -0.32 . . . . 0.0 110.763 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HB3' HD13 ' A' ' 25' ' ' LEU . 1.5 m-20 -62.48 -37.44 85.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.233 175.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.13 -46.85 60.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.945 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.649 ' HA ' HD12 ' A' ' 34' ' ' LEU . 88.0 t80 -66.67 -31.46 72.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.945 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -53.0 63.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.001 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.451 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.3 OUTLIER -71.03 -26.31 63.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.896 177.701 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.649 HD12 ' HA ' ' A' ' 31' ' ' TYR . 7.1 mt -60.14 -55.36 34.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.24 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.473 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 0.2 OUTLIER -73.49 -32.11 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.282 -176.974 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -77.33 -28.59 53.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.95 0.405 . . . . 0.0 111.077 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -125.85 100.7 30.51 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.736 -177.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.19 0.65 3.07 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.028 2.485 . . . . 0.0 112.887 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.68 -24.77 20.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.249 0.547 . . . . 0.0 109.814 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.693 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 55.8 mt -89.11 107.24 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.26 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.561 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.3 OUTLIER -95.11 145.37 25.04 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.513 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 88' ' ' PHE . 5.8 tp -103.36 130.04 50.56 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 92.3 mt -113.83 120.47 63.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.676 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.806 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -102.16 132.35 48.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.437 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -113.84 99.5 8.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.136 -178.664 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.636 ' HD2' ' OE2' ' A' ' 50' ' ' GLU . 3.9 mmt180 -156.51 -177.2 6.42 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.639 ' HB3' ' HD2' ' A' ' 48' ' ' PRO . 63.3 m-20 -111.35 168.98 6.8 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.639 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 55.9 Cg_endo -77.84 -23.44 9.44 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 121.863 1.709 . . . . 0.0 114.454 -168.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.69 -49.64 51.54 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.141 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.636 ' OE2' ' HD2' ' A' ' 46' ' ' ARG . 11.5 pm0 -70.25 -33.53 71.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.576 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.627 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.9 OUTLIER -62.73 -37.33 86.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.117 178.123 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -37.31 84.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.35 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.64 -50.56 10.47 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -172.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -100.3 -33.57 10.35 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.139 -174.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 176.47 14.56 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.799 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.627 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -143.89 158.42 56.05 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.407 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 15.6 Cg_endo -62.83 138.45 68.89 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 121.996 1.797 . . . . 0.0 112.589 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.406 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 3.6 t70 -112.41 94.05 4.74 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.686 177.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.729 HG22 ' HB2' ' A' ' 62' ' ' TYR . 2.0 m -131.95 162.61 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.303 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -55.17 -45.56 75.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.045 -176.996 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.561 ' HB2' HG23 ' A' ' 41' ' ' THR . 14.0 p30 -122.56 73.48 1.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.76 0.79 . . . . 0.0 111.027 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.806 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.6 t80 -114.95 128.41 56.27 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.981 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HE2' HG21 ' A' ' 41' ' ' THR . 3.4 mtmt -120.46 121.44 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.807 0.337 . . . . 0.0 110.444 177.377 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -90.14 116.17 27.94 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 176.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.838 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -110.94 93.54 4.54 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.831 -175.945 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.36 119.81 40.59 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.32 0.581 . . . . 0.0 112.026 -176.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.559 ' HA ' ' NE ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -155.81 -122.85 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 170.281 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -77.01 -46.05 10.95 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 118.448 -1.834 . . . . 0.0 109.76 168.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.517 ' HE3' ' HA ' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -166.56 52.22 0.08 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.366 -0.417 . . . . 0.0 111.135 171.774 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.789 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 76.68 -8.32 1.69 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 172.629 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.68 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 0.4 OUTLIER -49.32 -64.84 1.0 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.041 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.68 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 11.4 Cg_exo -73.86 -17.26 22.83 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.205 1.937 . . . . 0.0 113.219 -176.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.838 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.6 OUTLIER -91.52 -29.01 17.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -173.595 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.68 HD12 HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -62.42 -29.81 70.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.299 0.571 . . . . 0.0 111.411 -177.849 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.562 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -71.18 -32.75 69.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.697 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.82 -15.33 42.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -174.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -27.39 59.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 -176.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.1 61.07 0.86 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.601 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.68 HD13 HD12 ' A' ' 74' ' ' LEU . 11.1 mt -114.54 146.08 41.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.744 0.307 . . . . 0.0 110.688 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -136.71 150.23 69.43 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.419 176.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.65 17.01 0.47 Allowed 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 123.008 2.472 . . . . 0.0 113.667 -175.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.73 -1.28 19.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.155 0.503 . . . . 0.0 109.765 174.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 9.5 mmtm -100.06 128.73 30.03 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.047 -177.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.693 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 4.7 Cg_exo -74.83 122.17 7.11 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.565 2.177 . . . . 0.0 110.103 173.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.441 HG23 HD12 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -127.32 149.48 32.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 120.988 0.423 . . . . 0.0 111.132 -174.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -122.34 137.88 54.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.246 175.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.539 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 6.4 m -105.81 134.1 48.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.947 ' HB2' HD11 ' A' ' 42' ' ' LEU . 24.9 t80 -118.23 144.15 45.99 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.424 -173.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 81.96 72.16 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.766 0.826 . . . . 0.0 110.747 -175.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.902 ' HA ' ' H ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -93.75 1.73 56.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.871 -177.244 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.501 ' HB ' ' H ' ' A' ' 92' ' ' ALA . 0.0 OUTLIER -77.23 -102.45 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -175.049 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.573 ' HA ' ' O ' ' B' ' 68' ' ' GLY . . . -68.52 -43.5 76.62 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -174.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.488 ' HB2' ' HD3' ' A' ' 46' ' ' ARG . . . -73.13 -27.17 61.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.581 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.404 ' HG3' ' HG2' ' B' ' 69' ' ' LYS . 0.1 OUTLIER 68.5 78.86 0.22 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.963 177.261 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.902 ' H ' ' HA ' ' A' ' 90' ' ' LYS . . . -64.75 -8.97 16.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.55 173.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.26 -36.72 76.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.556 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 97' ' ' LEU . 3.4 mm? -70.44 -30.05 66.79 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.363 176.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.83 -41.45 52.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.739 -177.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.63 -44.17 3.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.665 -171.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.41 ' HB3' ' CE ' ' A' ' 22' ' ' MET . 0.0 OUTLIER -65.26 -23.72 67.12 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.642 -0.328 . . . . 0.0 111.516 -174.858 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -54.24 14.81 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.131 0.491 . . . . 0.0 111.252 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.624 ' HB2' HD13 ' A' ' 110' ' ' ILE . 57.0 mt -56.27 -38.17 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.198 -172.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.05 -31.21 70.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.121 -179.567 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.86 -8.65 58.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.851 0.357 . . . . 0.0 110.938 176.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.594 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 16.7 m-30 -92.77 -38.28 11.88 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.09 50.94 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.476 -0.868 . . . . 0.0 112.583 174.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.426 ' CE1' HD22 ' A' ' 102' ' ' LEU . 2.2 m-85 -92.92 159.73 15.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.617 0.246 . . . . 0.0 110.623 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -69.02 0.39 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.466 -177.079 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.05 117.4 12.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.981 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.624 HD13 ' HB2' ' A' ' 102' ' ' LEU . 1.0 OUTLIER -119.16 128.84 75.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.217 0.532 . . . . 0.0 110.948 -179.578 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -119.27 152.28 36.96 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.544 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -121.98 148.48 44.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 5.8 m -89.11 113.47 24.63 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -174.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.649 ' HG2' ' HB3' ' A' ' 24' ' ' MET . 1.0 OUTLIER -64.45 143.45 57.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.623 177.646 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 96.0 -104.93 3.17 Favored Glycine 0 N--CA 1.443 -0.854 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 171.11 -165.07 38.19 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' MET . . . . . 0.577 ' HA ' ' CZ ' ' A' ' 88' ' ' PHE . 9.5 tpt -65.41 -29.48 70.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.036 178.038 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -61.71 -28.77 69.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.002 178.457 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.741 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -73.56 -33.01 64.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 111.447 0.165 . . . . 0.0 111.447 -178.929 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.854 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 18.8 t-105 -61.33 -54.54 42.59 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.828 0.347 . . . . 0.0 110.069 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 121' ' ' LEU . 7.2 mt -62.89 -41.88 99.58 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.892 178.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.587 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.5 OUTLIER -65.33 -40.52 93.8 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.159 -177.007 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.601 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.7 tp10 -73.18 -4.89 35.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.918 0.39 . . . . 0.0 111.159 -177.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.49 27.33 63.63 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.771 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.601 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 97.1 mt -79.76 157.67 74.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 -178.646 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.405 ' HB2' ' O ' ' A' ' 58' ' ' ASP . 20.6 Cg_endo -57.09 120.36 8.23 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 123.299 2.666 . . . . 0.0 112.209 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.47 151.77 50.6 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.483 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.406 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 0.8 OUTLIER -100.52 107.87 19.67 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 176.506 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.06 139.81 27.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.385 -175.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -83.82 87.69 7.09 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.958 178.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 m -40.33 113.77 0.39 Allowed 'General case' 0 C--O 1.235 0.299 0 O-C-N 124.03 0.831 . . . . 0.0 112.475 -176.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 25.5 m170 -79.69 83.77 5.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.589 -177.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -110.41 -12.66 14.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.83 0.348 . . . . 0.0 111.151 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -99.89 2.74 44.07 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.233 0.54 . . . . 0.0 110.081 177.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -84.24 63.11 7.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.527 176.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.25 -0.98 43.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.084 -177.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.705 -1.14 . . . . 0.0 109.095 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 121.089 0.471 . . . . 0.0 110.032 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -167.62 33.59 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.458 -175.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.75 0.05 40.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.107 -178.153 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' GLY . . . . . 0.76 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.67 -32.86 70.31 Favored Glycine 0 C--O 1.223 -0.541 0 CA-C-N 116.055 -0.52 . . . . 0.0 112.195 178.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.12 -31.61 62.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.059 0.457 . . . . 0.0 110.599 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -69.35 -57.19 5.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.076 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.76 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 3.8 p90 -72.56 -26.64 61.81 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.039 -0.664 . . . . 0.0 111.089 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ASP . . . . . 0.562 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 0.3 OUTLIER -53.59 -42.78 67.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.556 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.07 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.995 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.82 -45.06 83.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.706 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' PHE . . . . . 0.594 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 0.1 OUTLIER -55.9 -46.94 78.23 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.307 0.575 . . . . 0.0 110.345 177.168 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 12' ' ' LYS . . . . . 0.642 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.24 -27.5 69.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.397 178.757 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.03 58.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.177 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -70.96 -50.61 32.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.465 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.477 HG21 ' HG2' ' A' ' 71' ' ' GLU . 0.9 OUTLIER -63.46 -33.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.949 -178.442 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.642 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -59.9 -39.36 85.09 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.573 0.225 . . . . 0.0 111.551 178.412 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.78 -26.39 68.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.977 0.418 . . . . 0.0 111.205 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.54 65.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.492 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -24.94 42.41 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.164 0.507 . . . . 0.0 111.128 173.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.61 -15.75 41.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.166 -173.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.98 -23.27 62.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -171.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.409 ' SD ' ' HB2' ' B' ' 112' ' ' ASN . 1.5 ptp -139.7 172.87 12.16 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.811 -177.135 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 22.9 t -67.27 109.55 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.553 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -83.43 121.16 26.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.251 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' LEU . . . . . 0.484 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.5 mt -129.5 141.63 50.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.9 -177.814 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.52 145.7 82.65 Favored Pre-proline 0 C--N 1.315 -0.934 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.552 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 1.3 Cg_endo -45.22 -29.74 4.57 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.01 3.14 . . . . 0.0 114.415 -175.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -44.84 49.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 111.143 177.048 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -29.9 68.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.472 178.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' B' ' 86' ' ' VAL . . . -74.35 -42.31 59.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.651 177.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' TYR . . . . . 0.507 ' CZ ' ' HG3' ' B' ' 126' ' ' PRO . 38.8 t80 -64.25 -40.59 96.33 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.036 0.446 . . . . 0.0 110.806 178.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 36' ' ' GLU . 0.1 OUTLIER -50.3 -53.76 26.26 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.262 -177.421 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.597 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.3 OUTLIER -74.94 -27.57 60.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.268 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' B' ' 42' ' ' LEU . 3.2 mt -63.85 -57.52 9.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.146 0.498 . . . . 0.0 112.027 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.28 -18.28 55.49 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.047 -172.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 32' ' ' LYS . 0.4 OUTLIER -98.2 -9.09 26.21 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.588 -176.537 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -133.76 106.74 11.72 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.818 0.342 . . . . 0.0 110.298 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' PRO . . . . . 0.446 ' HA ' HD21 ' B' ' 61' ' ' ASN . 27.6 Cg_exo -65.5 -2.73 6.57 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.23 2.62 . . . . 0.0 113.696 -176.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.54 -25.91 18.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.431 . . . . 0.0 110.115 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.597 HD12 ' HB2' ' B' ' 33' ' ' LEU . 9.1 mt -82.62 108.09 15.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.412 178.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.664 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -101.57 144.83 29.84 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.093 -177.681 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.93 HD11 ' HB2' ' B' ' 88' ' ' PHE . 0.9 OUTLIER -103.96 127.96 51.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.923 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 2.0 mp -108.82 119.58 58.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 175.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.875 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -110.08 136.12 49.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.701 -178.73 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.489 ' O ' ' HB1' ' B' ' 93' ' ' ALA . 0.0 OUTLIER -124.09 100.05 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.88 178.359 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -153.88 152.93 31.2 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.964 -174.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -69.68 135.13 88.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.771 0.319 . . . . 0.0 110.566 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.01 -19.22 68.6 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.084 2.523 . . . . 0.0 113.851 -175.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.32 -40.08 37.75 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.825 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -67.57 -35.21 78.58 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.833 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.7 OUTLIER -60.27 -34.76 74.17 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.66 174.296 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -71.97 -41.74 67.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.834 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.99 -47.77 14.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.151 -172.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 12.4 mtt -102.36 -34.31 9.23 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.607 -173.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.94 178.28 15.45 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.821 176.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' LYS . . . . . 0.833 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 6.6 pttt -135.18 155.3 79.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.86 127.44 25.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.892 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' ASP . . . . . 0.671 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 26.5 t0 -101.99 81.68 2.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.272 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.788 HG22 ' HB2' ' B' ' 62' ' ' TYR . 0.9 OUTLIER -120.13 157.48 22.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.194 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -51.96 63.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.643 -175.136 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.452 ' HB2' ' HA ' ' B' ' 41' ' ' THR . 0.2 OUTLIER -109.82 80.65 1.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 0.0 110.545 -179.241 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 62' ' ' TYR . . . . . 0.875 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.5 t80 -121.32 130.56 53.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.046 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.664 ' HE2' HG21 ' B' ' 41' ' ' THR . 3.9 mttm -129.59 121.86 27.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.364 177.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -84.92 111.18 19.44 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' MET . . . . . 0.624 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.5 OUTLIER -109.34 98.05 7.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.729 0.299 . . . . 0.0 110.289 -177.719 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 2.6 m -117.85 120.67 38.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.186 0.517 . . . . 0.0 112.25 -173.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' B' ' 67' ' ' ARG . 0.0 OUTLIER -149.79 -131.46 0.05 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 172.247 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 68' ' ' GLY . . . . . 0.573 ' O ' ' HA ' ' A' ' 92' ' ' ALA . . . -86.97 -45.03 5.52 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 118.999 -1.572 . . . . 0.0 109.752 169.001 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' LYS . . . . . 0.461 ' HA ' ' HD3' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -143.99 43.3 1.45 Allowed 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 170.234 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.59 HD11 HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER 60.64 -7.3 0.08 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 173.712 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.611 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -44.82 -58.23 5.74 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -172.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.611 ' HD3' ' CD ' ' B' ' 71' ' ' GLU . 6.8 Cg_exo -73.52 -16.13 24.38 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.507 2.138 . . . . 0.0 112.818 -179.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.624 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -87.87 -19.68 27.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.458 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.651 HD21 HD21 ' B' ' 102' ' ' LEU . 24.2 tp -60.6 -51.42 69.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.701 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.602 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -63.85 -24.0 67.57 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.0 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.76 -22.05 50.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -177.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 77' ' ' SER . . . . . 0.574 ' HB2' ' HG ' ' B' ' 79' ' ' LEU . 0.3 OUTLIER -75.17 -39.65 60.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.803 0.335 . . . . 0.0 110.556 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.71 39.32 6.26 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.925 -177.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.574 ' HG ' ' HB2' ' B' ' 77' ' ' SER . 7.3 mt -83.2 151.75 25.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.602 0.239 . . . . 0.0 110.558 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.475 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.6 OUTLIER -125.48 133.72 25.13 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 81' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 37.4 Cg_exo -64.84 4.38 0.67 Allowed 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 123.502 2.801 . . . . 0.0 113.822 -176.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.37 -2.02 24.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.836 0.35 . . . . 0.0 110.799 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -109.74 146.03 33.21 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.94 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.576 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 7.9 Cg_exo -75.08 143.57 28.96 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 111.832 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.4 OUTLIER -143.74 147.43 19.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.759 -178.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.412 HG21 ' HB1' ' B' ' 30' ' ' ALA . 2.3 p -124.78 139.63 50.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 87' ' ' VAL . . . . . 0.572 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 4.4 m -109.28 124.31 65.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.094 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.93 ' HB2' HD11 ' B' ' 42' ' ' LEU . 9.6 t80 -104.4 136.62 43.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.148 -171.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 89' ' ' CYS . . . . . 0.426 ' HB3' ' HB3' ' B' ' 93' ' ' ALA . 0.1 OUTLIER 87.68 66.85 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 O-C-N 124.291 0.995 . . . . 0.0 111.661 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -75.08 -21.48 58.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.54 178.75 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 91' ' ' THR . . . . . 0.41 ' HB ' ' H ' ' B' ' 92' ' ' ALA . 0.1 OUTLIER -73.47 -107.85 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.984 -173.302 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.41 ' H ' ' HB ' ' B' ' 91' ' ' THR . . . -55.24 -41.6 72.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.111 0.482 . . . . 0.0 112.198 -175.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.489 ' HB1' ' O ' ' B' ' 45' ' ' VAL . . . -74.67 -27.93 60.63 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.09 -0.505 . . . . 0.0 112.018 -177.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 94' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' B' ' 94' ' ' ARG . 5.7 mmp_? 64.1 55.9 1.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.258 -179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.572 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -62.85 -14.38 45.27 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.179 177.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 96' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 112' ' ' ASN . . . -54.77 -29.5 54.21 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.276 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 97' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' B' ' 97' ' ' LEU . 1.9 mm? -70.28 -32.04 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.888 0.375 . . . . 0.0 111.054 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.03 -44.26 55.0 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.01 0.433 . . . . 0.0 110.838 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -80.45 -48.3 6.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.629 -0.796 . . . . 0.0 113.444 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 100' ' ' LYS . . . . . 0.434 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -59.62 -42.74 93.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.809 0.337 . . . . 0.0 111.56 -172.748 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 101' ' ' THR . . . . . 0.434 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 0.7 OUTLIER -69.71 -35.34 74.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.461 -178.094 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 102' ' ' LEU . . . . . 0.651 HD21 HD21 ' B' ' 74' ' ' LEU . 9.2 mt -62.56 -50.42 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.554 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 103' ' ' ARG . . . . . 0.575 ' HB3' HG21 ' B' ' 110' ' ' ILE . 0.9 OUTLIER -65.98 -30.69 71.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.887 0.375 . . . . 0.0 110.597 -179.891 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 104' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' B' ' 103' ' ' ARG . 7.2 mt-10 -71.24 -7.07 44.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.335 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -108.46 -11.51 15.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.746 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 129.74 14.73 2.05 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.017 -1.087 . . . . 0.0 113.89 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' PHE . . . . . 0.57 ' CE1' HD22 ' B' ' 102' ' ' LEU . 4.9 m-85 -70.97 140.23 50.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.399 0.599 . . . . 0.0 110.595 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.43 -81.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.784 -172.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -111.47 103.04 11.36 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.817 -176.213 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 110' ' ' ILE . . . . . 0.575 HG21 ' HB3' ' B' ' 103' ' ' ARG . 1.3 tt -114.47 131.1 67.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.472 0.653 . . . . 0.0 110.889 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -120.28 151.5 39.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.295 -178.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.587 HD21 ' HA ' ' B' ' 96' ' ' ALA . 4.6 t-20 -123.1 148.86 45.2 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.594 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 4.8 m -83.54 138.4 33.42 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.443 -177.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -97.39 152.99 18.38 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.117 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.98 -87.93 1.32 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.793 -176.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 116' ' ' GLY . . . . . 0.525 ' HA3' ' S5 ' ' B' ' 139' ' ' PS5 . . . 150.31 -166.81 30.13 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.033 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 117' ' ' MET . . . . . 0.504 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 7.7 tmm? -67.96 -33.01 73.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.991 0.424 . . . . 0.0 110.66 179.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -63.87 -29.63 70.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.634 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 119' ' ' LYS . . . . . 0.552 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -69.14 -33.56 73.63 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.868 -0.151 . . . . 0.0 111.368 177.872 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.847 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 34.8 t-105 -60.86 -53.56 55.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 121' ' ' LEU . 9.5 mt -64.94 -39.73 93.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 178.003 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.569 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.3 OUTLIER -63.94 -34.62 78.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.716 -176.942 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 123' ' ' GLU . . . . . 0.553 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.7 OUTLIER -82.49 -0.85 48.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.939 0.399 . . . . 0.0 111.095 -178.576 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.26 29.38 68.55 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.143 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.553 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 77.6 mt -79.68 160.77 68.8 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.604 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 21.9 Cg_endo -57.42 121.9 10.84 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 123.042 2.495 . . . . 0.0 112.152 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.56 151.14 52.02 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.436 -178.158 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 128' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.1 mt -109.7 101.37 10.28 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.05 144.91 51.8 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -177.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 130' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' B' ' 130' ' ' ARG . 0.3 OUTLIER -88.48 82.16 7.01 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.482 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.1 m -42.41 116.22 0.81 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.962 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 132' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' B' ' 135' ' ' HIS . 66.8 m80 -81.04 64.75 5.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.859 -175.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -75.39 -12.41 60.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.979 0.419 . . . . 0.0 110.799 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -79.92 -4.54 52.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.071 175.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 135' ' ' HIS . . . . . 0.469 ' HB2' ' O ' ' B' ' 132' ' ' HIS . 0.1 OUTLIER -81.48 62.69 5.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.184 0.516 . . . . 0.0 110.667 179.236 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -73.06 -18.16 61.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.06 178.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.211 -0.9 . . . . 0.0 109.501 177.224 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 138' ' ' PS5 . . . . . 0.451 ' S3 ' ' HB3' ' A' ' 117' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 139' ' ' PS5 . . . . . 0.551 ' S5 ' ' HB3' ' B' ' 118' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.421 ' HA ' ' OD1' ' B' ' 80' ' ' ASP . . . . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.032 0.444 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -138.14 -5.06 1.67 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.052 -178.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.428 ' HG3' ' HB2' ' A' ' 6' ' ' LYS . 2.8 tpp -80.39 8.34 7.79 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.576 -178.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.588 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -55.99 -32.03 59.14 Favored Glycine 0 C--O 1.229 -0.192 0 CA-C-N 116.205 -0.452 . . . . 0.0 112.943 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.19 -33.08 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.75 0.31 . . . . 0.0 111.095 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.428 ' HB2' ' HG3' ' A' ' 3' ' ' MET . 20.1 mmtt -68.9 -58.04 4.69 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -172.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.588 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.6 OUTLIER -72.29 -34.05 67.89 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.468 -173.496 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.72 -57.35 11.17 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 123.309 0.381 . . . . 0.0 110.931 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.66 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m -67.15 -44.94 78.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.255 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 7' ' ' PHE . 0.3 OUTLIER -54.16 -42.96 70.2 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.32 0.581 . . . . 0.0 109.908 178.485 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -65.94 -26.24 67.49 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.904 177.869 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.85 -45.66 49.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.852 0.358 . . . . 0.0 110.914 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -71.77 -50.47 29.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.96 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.746 HG11 ' HG2' ' B' ' 71' ' ' GLU . 0.8 OUTLIER -68.38 -34.19 64.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.464 -172.628 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.539 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -66.53 -27.74 68.0 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.222 -0.299 . . . . 0.0 111.157 -177.973 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.73 66.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.005 0.431 . . . . 0.0 111.187 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.24 70.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.023 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -23.94 49.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.313 0.578 . . . . 0.0 110.93 175.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.77 -20.68 27.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.977 -176.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -32.86 73.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.46 ' HG3' ' HB2' ' A' ' 112' ' ' ASN . 6.6 ptm -125.7 178.73 5.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.98 0.419 . . . . 0.0 111.924 -175.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.0 t -74.58 111.44 10.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.098 -178.493 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.675 ' HE2' ' HB3' ' A' ' 112' ' ' ASN . 2.0 mmt -79.89 105.41 11.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.861 -178.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.442 ' HB2' ' HB3' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -113.11 139.63 48.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.096 0.474 . . . . 0.0 110.583 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.7 143.29 67.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.796 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -51.29 -24.33 15.4 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.632 2.888 . . . . 0.0 113.951 -176.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 mtmt -74.29 -43.87 55.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.071 0.462 . . . . 0.0 110.909 177.117 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.45 -29.13 62.35 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.566 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.61 -45.34 62.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.634 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.558 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 74.5 t80 -67.23 -32.02 72.78 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.997 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.8 tptt -56.29 -50.17 72.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.146 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.51 ' O ' ' HB2' ' A' ' 37' ' ' ASN . 0.3 OUTLIER -74.23 -27.53 60.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.678 177.648 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.641 HD11 ' HB2' ' A' ' 42' ' ' LEU . 2.5 mt -64.23 -48.27 76.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.027 0.441 . . . . 0.0 111.379 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -21.93 57.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.416 -175.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.98 -27.89 15.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 111.232 -177.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 5.9 m-80 -112.24 108.91 54.58 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.515 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -71.39 0.57 6.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 122.779 2.319 . . . . 0.0 112.037 177.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.72 -26.44 13.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.586 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.837 HG12 ' HG2' ' A' ' 84' ' ' PRO . 36.7 mt -80.66 113.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.73 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.79 144.06 31.98 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 -177.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.997 HD11 ' HB2' ' A' ' 88' ' ' PHE . 27.2 tp -96.56 121.41 38.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 88.2 mt -103.18 111.11 31.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.777 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -104.73 140.85 37.47 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' VAL . . . . . 0.408 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -124.18 98.22 5.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.489 177.549 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.552 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -144.19 149.17 35.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.404 179.249 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.552 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 4.5 m-20 -67.67 141.17 94.88 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.039 -175.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -58.13 -25.75 72.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.546 2.831 . . . . 0.0 114.464 -169.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.21 -43.48 57.01 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.974 -0.69 . . . . 0.0 111.955 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 46' ' ' ARG . 27.2 tt0 -65.1 -35.37 80.9 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.857 176.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.659 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -57.38 -35.42 69.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.72 176.353 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.5 mtpt -79.61 -43.54 22.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.253 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -91.12 -48.07 7.17 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 mtm -95.56 -35.1 11.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.339 -174.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.69 171.03 12.9 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 113.641 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.659 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -142.49 162.35 45.12 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -62.83 132.44 37.3 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 121.934 1.756 . . . . 0.0 112.679 -176.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' A' ' 126' ' ' PRO . 20.0 t0 -107.37 77.41 1.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.068 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.448 HG22 ' HB2' ' A' ' 62' ' ' TYR . 3.0 m -119.3 166.78 13.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.6 -41.16 93.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.982 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 86.0 2.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.033 0.444 . . . . 0.0 111.036 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.777 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.0 OUTLIER -128.98 132.81 47.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.56 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.95 119.78 32.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.473 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -86.68 118.73 26.28 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 175.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.738 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -113.26 91.8 3.78 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.264 -174.713 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.54 139.31 36.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.056 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.862 ' HG2' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -176.97 -143.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 177.841 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -79.59 -42.78 10.99 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 118.852 -1.642 . . . . 0.0 109.386 168.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.737 ' HE2' ' HG3' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -155.45 47.34 0.51 Allowed 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.558 -0.821 . . . . 0.0 110.075 171.418 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.738 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 64.99 -6.51 0.33 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 174.33 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.795 ' HG2' HG11 ' B' ' 15' ' ' VAL . 0.2 OUTLIER -44.05 -61.82 1.82 Allowed Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -172.952 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.862 ' HD2' ' HG2' ' A' ' 67' ' ' ARG . 7.6 Cg_exo -73.86 -15.85 23.59 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.448 2.098 . . . . 0.0 113.146 -178.038 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.6 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.1 OUTLIER -90.01 -19.08 24.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.908 0.385 . . . . 0.0 110.874 -177.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.495 ' CD1' HD21 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -73.14 -28.94 62.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.385 0.612 . . . . 0.0 110.43 -179.615 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.56 -28.28 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.958 173.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -18.06 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.943 -177.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -41.3 27.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.969 0.414 . . . . 0.0 110.281 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.85 55.34 1.15 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.395 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.9 mt -94.32 145.22 24.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.665 0.269 . . . . 0.0 110.493 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -127.1 158.1 70.08 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.546 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 45.5 Cg_endo -70.93 9.16 0.84 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.89 2.393 . . . . 0.0 114.158 -174.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.406 ' H ' ' HG3' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -118.06 -1.9 11.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.824 0.345 . . . . 0.0 110.585 179.062 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.3 mmtm -88.53 134.6 33.89 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.29 -176.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.837 ' HG2' HG12 ' A' ' 40' ' ' ILE . 27.9 Cg_endo -88.29 124.31 1.7 Allowed 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.05 2.5 . . . . 0.0 111.261 175.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.508 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -135.35 149.92 28.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 111.205 -176.079 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -124.29 141.2 45.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.916 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 8.0 m -106.91 133.53 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.997 ' HB2' HD11 ' A' ' 42' ' ' LEU . 14.4 t80 -116.97 137.2 52.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.935 -171.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 117' ' ' MET . 0.1 OUTLIER 84.24 101.43 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.407 1.067 . . . . 0.0 112.034 178.927 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.741 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -124.09 11.49 8.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.027 178.138 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.84 17.78 17.32 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -174.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -165.83 -72.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.089 0.471 . . . . 0.0 110.405 177.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.85 -27.44 63.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.313 177.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.762 ' HG3' ' HG2' ' B' ' 69' ' ' LYS . 1.3 mmt85 67.97 90.88 0.09 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.685 177.876 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.916 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . -66.03 -9.06 27.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.242 177.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.453 ' HA ' ' ND2' ' A' ' 112' ' ' ASN . . . -58.64 -34.94 71.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.194 179.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -67.11 -30.41 70.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.866 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.52 -40.6 49.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.791 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -96.86 -40.8 3.72 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.852 -171.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -25.02 67.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.847 0.356 . . . . 0.0 111.24 -174.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.59 -49.67 38.19 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.842 177.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.495 HD21 ' CD1' ' A' ' 74' ' ' LEU . 22.8 mt -57.79 -42.21 83.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.682 -174.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.412 ' HD3' ' HB3' ' A' ' 22' ' ' MET . 0.0 OUTLIER -68.68 -26.62 65.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.84 0.352 . . . . 0.0 110.742 178.314 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.71 -8.39 57.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.226 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.477 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 14.2 m-85 -105.26 -42.05 5.37 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 176.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 142.53 85.32 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.349 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.453 ' CE1' HD22 ' A' ' 102' ' ' LEU . 1.5 m-85 -126.44 156.75 40.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.605 0.24 . . . . 0.0 110.601 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -71.29 0.24 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.354 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.45 111.94 9.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.05 -177.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.508 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 1.5 tt -122.92 128.94 75.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.304 0.573 . . . . 0.0 111.062 -178.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.442 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 0.9 OUTLIER -117.52 149.84 39.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.501 -177.206 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.675 ' HB3' ' HE2' ' A' ' 24' ' ' MET . 8.1 t-20 -118.63 144.77 45.93 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.454 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 92.0 p -81.56 135.57 35.58 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.137 0.494 . . . . 0.0 111.95 -171.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.49 136.74 33.3 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.617 169.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 87.07 -127.13 8.28 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.271 -172.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -178.75 -159.96 23.98 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' MET . . . . . 0.464 ' HB2' ' SG ' ' A' ' 89' ' ' CYS . 0.0 OUTLIER -58.78 -33.79 70.71 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.401 . . . . 0.0 110.712 178.663 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASP . . . . . 0.478 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.25 -34.37 72.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.962 178.465 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.451 ' HD2' ' OD1' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -73.93 -32.14 63.38 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.488 0.185 . . . . 0.0 111.174 -179.385 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.749 ' HB2' ' HZ ' ' A' ' 88' ' ' PHE . 18.6 t-105 -62.39 -54.28 42.58 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 121' ' ' LEU . 2.2 mt -63.77 -42.4 97.78 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.7 0.286 . . . . 0.0 111.045 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 2.1 tt0 -62.1 -40.98 97.69 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.793 -177.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.545 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.8 OUTLIER -77.78 -0.72 28.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 69.12 29.67 72.14 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.925 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.545 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 75.2 mt -77.4 158.42 79.15 Favored Pre-proline 0 N--CA 1.45 -0.472 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.545 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 19.7 Cg_endo -55.31 114.41 1.86 Allowed 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 123.262 2.642 . . . . 0.0 112.129 -179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.78 152.9 51.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.073 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.0 mt -102.96 100.5 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.32 143.44 49.01 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.775 -178.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.37 114.73 27.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.55 -176.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.36 100.05 0.6 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.828 -179.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -79.48 66.87 5.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.516 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -86.41 1.04 52.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.435 -173.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -95.08 47.36 1.14 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.124 0.488 . . . . 0.0 110.173 177.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -120.42 41.89 3.12 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.471 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.5 -26.08 62.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.166 0.507 . . . . 0.0 109.661 177.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 2.7 t60 . . . . . 0 C--O 1.253 1.251 0 CA-C-O 117.784 -1.103 . . . . 0.0 108.515 177.533 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.004 0 CA-C-O 120.822 0.344 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -150.29 129.39 12.69 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.105 0.479 . . . . 0.0 110.316 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' MET . . . . . 0.546 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mpp? -94.53 3.22 55.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.587 -177.259 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' GLY . . . . . 0.585 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.85 -33.7 69.11 Favored Glycine 0 C--O 1.226 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.52 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -31.25 62.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.864 0.364 . . . . 0.0 111.143 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.461 ' HG3' ' HA ' ' B' ' 3' ' ' MET . 4.8 mmtt -72.29 -58.06 3.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.269 -172.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.585 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.1 p90 -73.69 -27.09 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.26 -175.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -47.12 69.38 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.425 0.453 . . . . 0.0 110.425 -177.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.9 -43.55 86.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.322 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -42.97 77.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.75 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' PHE . . . . . 0.477 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 1.0 OUTLIER -55.33 -48.76 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.307 0.575 . . . . 0.0 110.398 178.101 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 12' ' ' LYS . . . . . 0.646 ' HE2' ' HB2' ' A' ' 71' ' ' GLU . 1.8 tppt? -65.8 -26.05 67.52 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.94 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.19 -41.63 63.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.143 0.497 . . . . 0.0 111.061 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.55 -49.14 43.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.272 177.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.795 HG11 ' HG2' ' A' ' 71' ' ' GLU . 1.2 t -64.45 -34.35 68.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.03 -174.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.584 ' HD2' ' HG3' ' B' ' 12' ' ' LYS . 0.2 OUTLIER -68.35 -38.9 81.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.692 0.282 . . . . 0.0 111.187 -178.814 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.27 -32.32 68.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.806 -177.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.81 73.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.141 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.43 -23.77 42.94 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.456 0.646 . . . . 0.0 110.803 173.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.67 -14.01 46.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.957 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -73.99 -20.39 60.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.115 -174.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.593 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 3.4 ptm -122.45 177.77 5.26 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.91 0.386 . . . . 0.0 111.503 -178.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.9 t -74.49 110.62 9.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.595 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.03 109.08 14.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.688 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' B' ' 25' ' ' LEU . 2.7 mt -112.16 -168.76 1.36 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.052 0.453 . . . . 0.0 110.513 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 1.1 p -129.82 144.61 53.7 Favored Pre-proline 0 C--N 1.321 -0.67 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.424 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 7.9 Cg_endo -52.76 -17.18 6.82 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 123.34 2.693 . . . . 0.0 113.817 -176.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -73.05 -47.08 47.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.946 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.47 -33.22 42.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.725 178.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.537 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -64.21 -47.02 81.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.579 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 31' ' ' TYR . . . . . 0.672 ' HA ' HD12 ' B' ' 34' ' ' LEU . 39.0 t80 -66.92 -30.95 71.23 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.714 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -47.15 87.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.666 0.27 . . . . 0.0 111.32 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.608 HD13 HG21 ' B' ' 40' ' ' ILE . 0.3 OUTLIER -70.03 -26.57 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.088 -0.245 . . . . 0.0 110.991 178.934 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.672 HD12 ' HA ' ' B' ' 31' ' ' TYR . 51.7 mt -72.43 -45.36 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 110.705 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -73.59 -24.12 60.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.094 -174.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -105.13 -9.59 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' ASN . . . . . 0.555 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 42.7 m-20 -129.47 111.18 17.8 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.731 0.3 . . . . 0.0 110.525 178.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -71.9 -1.63 10.25 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.155 2.57 . . . . 0.0 112.801 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -105.78 -26.31 11.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.542 -177.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.608 HG21 HD13 ' B' ' 33' ' ' LEU . 36.1 mt -77.53 110.58 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 175.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -100.64 144.67 29.34 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.791 -173.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.841 HD11 ' HB2' ' B' ' 88' ' ' PHE . 3.1 tp -104.85 125.31 50.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.3 mp -104.34 114.05 42.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 175.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.827 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -102.8 133.9 47.08 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.446 -178.849 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 45' ' ' VAL . . . . . 0.493 ' O ' ' HG2' ' B' ' 46' ' ' ARG . 0.1 OUTLIER -122.13 97.86 5.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.547 -178.615 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ARG . . . . . 0.584 ' HD2' ' S1 ' ' B' ' 139' ' ' PS5 . 0.0 OUTLIER -149.21 164.35 35.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.731 -178.54 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -71.55 137.01 83.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.668 0.271 . . . . 0.0 110.961 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.04 -26.68 58.02 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.688 2.258 . . . . 0.0 113.54 -177.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' ASP . . . . . 0.653 ' HA ' ' HD3' ' B' ' 52' ' ' LYS . 4.2 t0 -78.39 -33.25 48.94 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.233 176.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 50' ' ' GLU . . . . . 0.482 ' CD ' HH21 ' B' ' 46' ' ' ARG . 3.5 mt-10 -65.14 -34.76 79.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.073 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.872 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 mp -65.42 -35.12 79.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.432 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' LYS . . . . . 0.653 ' HD3' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -69.62 -39.97 76.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.436 178.324 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.11 -48.31 13.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 112.609 -173.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -97.52 -35.01 10.78 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.492 -172.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.12 172.72 14.93 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.91 -0.662 . . . . 0.0 111.794 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' LYS . . . . . 0.872 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 11.9 pttt -140.47 155.31 69.91 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.407 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 11.8 Cg_endo -59.02 124.26 15.29 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.51 2.14 . . . . 0.0 112.684 -177.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' ASP . . . . . 0.711 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 33.8 t0 -97.25 73.76 2.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.344 0.592 . . . . 0.0 110.486 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.624 HG22 ' HB2' ' B' ' 62' ' ' TYR . 2.8 m -113.31 171.26 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -30.07 55.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.979 0.419 . . . . 0.0 111.364 -174.818 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -122.55 65.23 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.649 -177.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' TYR . . . . . 0.827 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 1.2 t80 -114.85 125.29 53.5 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.477 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.424 ' HB3' ' HE1' ' B' ' 65' ' ' MET . 2.1 mttt -123.55 119.59 30.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -80.93 115.48 20.42 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' MET . . . . . 0.773 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER -113.34 91.24 3.58 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.443 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.99 88.59 2.96 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.049 0.452 . . . . 0.0 111.917 -173.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.0 -128.64 0.29 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 170.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -84.37 -43.72 6.87 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 109.305 -1.518 . . . . 0.0 109.305 168.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' LYS . . . . . 0.887 ' HE3' ' HA ' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -148.02 44.71 1.08 Allowed 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.45 -0.875 . . . . 0.0 109.439 170.449 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.704 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.1 OUTLIER 59.65 -2.58 0.13 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 175.476 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.746 ' HG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -45.39 -60.71 2.98 Favored Pre-proline 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.16 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 11.8 Cg_exo -73.24 -16.09 25.16 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.576 2.184 . . . . 0.0 113.225 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.773 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -85.53 -15.79 41.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.142 -175.805 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.949 HD21 HD21 ' B' ' 102' ' ' LEU . 9.5 tp -58.56 -49.19 78.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.262 0.553 . . . . 0.0 110.807 -179.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.32 -26.57 66.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.333 -179.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -74.43 -29.59 61.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.009 -175.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.54 -34.51 67.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 111.096 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.91 50.47 2.86 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.59 -0.815 . . . . 0.0 111.284 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 20.0 mt -97.23 148.42 23.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.778 0.323 . . . . 0.0 110.614 -178.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.462 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.5 OUTLIER -136.38 137.54 24.57 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.538 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 81' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 30.1 Cg_exo -67.23 24.17 0.11 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.416 2.744 . . . . 0.0 114.222 -174.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.6 4.01 23.52 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.33 0.586 . . . . 0.0 109.793 174.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 83' ' ' LYS . . . . . 0.453 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.2 mttp -119.17 132.86 23.8 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.16 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' B' ' 83' ' ' LYS . 6.1 Cg_exo -69.62 143.01 50.15 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.453 2.102 . . . . 0.0 110.865 174.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.557 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 2.1 m -141.47 151.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -176.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.481 HG23 ' HB2' ' B' ' 111' ' ' TYR . 2.8 p -127.46 142.79 42.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 175.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 87' ' ' VAL . . . . . 0.806 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 18.6 m -104.93 157.9 5.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.841 ' HB2' HD11 ' B' ' 42' ' ' LEU . 4.4 t80 -122.99 111.4 16.56 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 4.5 t 87.29 99.43 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.171 1.389 . . . . 0.0 112.781 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.489 ' H ' ' HG3' ' B' ' 90' ' ' LYS . 0.0 OUTLIER -80.54 2.38 25.68 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.587 173.749 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.06 158.28 15.53 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.829 -178.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . 58.31 -87.66 0.02 OUTLIER 'General case' 0 C--O 1.237 0.399 0 C-N-CA 123.285 0.634 . . . . 0.0 112.296 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' B' ' 94' ' ' ARG . . . -70.6 -27.62 64.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.65 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 94' ' ' ARG . . . . . 0.737 ' HG3' ' HE2' ' A' ' 69' ' ' LYS . 0.8 OUTLIER 69.99 84.78 0.14 Allowed 'General case' 0 C--O 1.232 0.182 0 O-C-N 124.014 0.821 . . . . 0.0 111.822 177.344 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 95' ' ' ALA . . . . . 0.806 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -66.22 -12.65 57.42 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.807 175.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.16 67.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 178.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' B' ' 97' ' ' LEU . 2.1 mm? -76.27 -28.07 56.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.271 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' ALA . . . . . 0.611 ' HA ' HD21 ' B' ' 70' ' ' LEU . . . -72.44 -30.94 65.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.321 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 99' ' ' GLY . . . . . 0.449 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -103.76 -46.22 1.42 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.727 -174.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 100' ' ' LYS . . . . . 0.429 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -62.46 -33.12 74.2 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.571 -0.37 . . . . 0.0 111.142 -174.832 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 101' ' ' THR . . . . . 0.429 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 1.2 m -73.46 -36.29 65.83 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.941 0.4 . . . . 0.0 111.061 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 102' ' ' LEU . . . . . 0.949 HD21 HD21 ' B' ' 74' ' ' LEU . 5.6 mt -67.78 -38.53 83.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.258 -176.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -26.13 67.25 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.917 0.389 . . . . 0.0 110.612 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.43 -5.58 50.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.273 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 105' ' ' TYR . . . . . 0.417 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 22.0 m-30 -105.8 -8.14 17.93 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.078 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 123.73 5.05 7.81 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.012 -1.09 . . . . 0.0 113.734 171.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' PHE . . . . . 0.418 ' CE1' HD22 ' B' ' 102' ' ' LEU . 8.7 m-85 -69.4 130.54 42.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 117.034 0.417 . . . . 0.0 110.589 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -57.58 -80.76 0.02 OUTLIER 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.087 -172.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.06 115.7 26.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.968 -177.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 110' ' ' ILE . . . . . 0.557 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.4 tt -118.92 127.37 75.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.604 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 111' ' ' TYR . . . . . 0.481 ' HB2' HG23 ' B' ' 86' ' ' VAL . 4.7 m-85 -113.39 144.5 42.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.387 -175.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.593 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 17.9 t-20 -117.62 143.41 46.16 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.146 -0.686 . . . . 0.0 109.146 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.611 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -83.06 134.32 35.03 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.633 -175.869 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.69 153.91 20.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.826 -1.079 . . . . 0.0 108.373 164.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 115' ' ' GLY . . . . . 0.597 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 82.9 -108.44 2.98 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 -173.079 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.15 -156.14 27.35 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.75 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 1.6 ttt -61.43 -35.21 76.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.961 0.41 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.534 ' HB3' ' S4 ' ' B' ' 139' ' ' PS5 . 0.2 OUTLIER -57.8 -38.57 75.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.639 177.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 119' ' ' LYS . . . . . 0.597 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -66.46 -33.21 75.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.805 -179.495 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.679 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 30.7 t-105 -59.99 -53.62 55.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 121' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' B' ' 121' ' ' LEU . 12.8 mt -64.31 -39.69 94.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.861 177.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -61.59 -40.64 95.5 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.957 0.408 . . . . 0.0 111.369 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -74.05 -12.49 60.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.802 -179.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.2 56.98 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.572 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.45 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 83.7 mt -80.34 159.3 70.35 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.273 . . . . 0.0 110.607 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 14.3 Cg_endo -54.57 119.36 6.29 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 123.09 2.526 . . . . 0.0 112.163 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.48 152.75 51.42 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.316 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 128' ' ' LEU . . . . . 0.711 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 3.2 mt -102.31 102.02 12.35 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.607 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.63 136.5 41.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.156 -175.394 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -89.11 78.92 7.31 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.7 m -45.16 123.93 4.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.831 -1.077 . . . . 0.0 112.725 -171.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 132' ' ' HIS . . . . . 0.583 ' HB3' ' HB2' ' B' ' 135' ' ' HIS . 45.3 m170 -82.52 69.47 9.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.042 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 37.7 t-80 -65.2 -37.06 86.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.586 -175.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -94.84 2.64 55.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 135' ' ' HIS . . . . . 0.583 ' HB2' ' HB3' ' B' ' 132' ' ' HIS . 1.1 t60 -79.58 65.71 4.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.02 0.438 . . . . 0.0 111.012 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -77.4 -31.12 53.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.903 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 117.926 -1.035 . . . . 0.0 109.184 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 139' ' ' PS5 . . . . . 0.584 ' S1 ' ' HD2' ' B' ' 46' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.445 ' HB1' ' SD ' ' A' ' 3' ' ' MET . . . . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.924 0.392 . . . . 0.0 110.342 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.43 67.21 6.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.317 0.579 . . . . 0.0 110.015 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.445 ' SD ' ' HB1' ' A' ' 1' ' ' ALA . 0.0 OUTLIER -95.86 19.02 12.04 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.563 -173.903 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.603 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -63.61 -52.27 47.4 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.041 178.689 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -59.75 -32.46 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.528 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -66.42 -57.51 7.24 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.055 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.603 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.3 OUTLIER -84.28 -22.7 30.64 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -175.624 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.627 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 17.5 t70 -54.27 -41.94 69.41 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 111.023 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.83 -37.7 67.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.137 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -43.11 82.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.475 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.412 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.8 OUTLIER -58.18 -41.68 84.43 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.093 -179.309 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.594 ' HE2' ' HG3' ' B' ' 72' ' ' PRO . 12.2 tptp -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.164 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.97 -46.34 30.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.492 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -70.59 -51.86 25.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.798 -176.017 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.47 -34.32 50.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.898 0.38 . . . . 0.0 110.865 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.5 tptm -62.08 -36.08 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.395 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.62 -26.01 68.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.281 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.83 -31.91 71.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.656 176.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 7.2 mtpp -75.86 -21.06 57.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.46 0.648 . . . . 0.0 110.819 173.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.46 46.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.279 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -75.64 -15.28 60.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.889 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.686 ' HG3' HG23 ' A' ' 110' ' ' ILE . 1.5 mpp? -121.58 -179.45 4.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.965 0.412 . . . . 0.0 111.237 -177.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.5 t -88.22 105.81 15.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.61 175.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.801 ' HG3' ' HG2' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -73.45 100.04 3.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.856 0.36 . . . . 0.0 110.29 -177.627 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.493 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -116.27 142.51 46.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.193 0.52 . . . . 0.0 111.127 -175.743 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.18 138.41 48.96 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.853 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.58 ' HA ' ' HB3' ' A' ' 30' ' ' ALA . 10.1 Cg_endo -52.65 -14.46 3.28 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.697 2.932 . . . . 0.0 114.308 -176.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.42 -45.78 52.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.836 0.351 . . . . 0.0 110.795 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.0 OUTLIER -79.6 -33.34 41.64 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.544 176.175 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.58 ' HB3' ' HA ' ' A' ' 27' ' ' PRO . . . -62.43 -39.52 93.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.453 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.498 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 63.5 t80 -74.19 -32.56 63.12 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -51.55 67.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.683 ' HB2' HD12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -73.85 -27.54 61.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.72 0.295 . . . . 0.0 110.864 178.509 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.855 HD11 ' HB2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.55 -50.59 72.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.207 0.527 . . . . 0.0 110.838 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -27.5 56.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -76.75 -31.9 57.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.77 0.319 . . . . 0.0 111.067 -177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASN . . . . . 0.76 ' HB2' HG13 ' A' ' 40' ' ' ILE . 44.6 m-20 -119.73 114.42 34.15 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.842 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 15.6 Cg_exo -68.74 -0.27 5.86 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.197 2.598 . . . . 0.0 112.925 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -105.36 -18.48 14.1 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.193 179.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.82 HG12 ' HG2' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -74.27 114.37 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.615 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.529 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -107.64 140.04 41.26 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.793 -177.085 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.855 ' HB2' HD11 ' A' ' 34' ' ' LEU . 10.7 tp -103.93 120.92 42.04 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.562 HD11 HD21 ' A' ' 79' ' ' LEU . 1.3 mp -104.35 113.74 42.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.639 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 2.2 t70 -102.47 140.25 37.0 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.725 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -122.75 93.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.622 0.725 . . . . 0.0 109.777 173.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.552 ' HA ' HH21 ' A' ' 94' ' ' ARG . 11.9 mmm180 -143.27 152.64 41.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.415 178.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.94 142.07 64.29 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.498 -173.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -59.86 -25.28 78.92 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 123.37 2.714 . . . . 0.0 113.565 -172.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.81 -38.45 46.47 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.212 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.417 ' CD ' HH12 ' A' ' 46' ' ' ARG . 0.4 OUTLIER -72.91 -37.44 67.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 175.268 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.968 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.3 tp -59.35 -33.31 71.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.519 174.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -37.59 60.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.132 178.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.48 -49.66 13.02 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -174.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -100.11 -35.8 9.55 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.289 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.15 178.48 15.33 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.459 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.968 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -140.58 154.06 68.83 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.429 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.6 Cg_endo -61.38 123.27 12.46 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 121.976 1.784 . . . . 0.0 112.674 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 46.7 t0 -86.54 93.56 9.21 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 174.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 1.041 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -129.84 151.42 35.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.234 -177.466 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.87 76.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.172 0.51 . . . . 0.0 110.911 -178.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -116.95 66.84 0.72 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.356 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 1.041 ' HB2' HG23 ' A' ' 59' ' ' VAL . 12.2 t80 -108.38 122.52 47.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.611 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.529 ' HE2' HG21 ' A' ' 41' ' ' THR . 18.9 mttm -122.83 109.31 14.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -93.11 114.53 27.07 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' MET . . . . . 0.547 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -102.55 171.28 7.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.841 0.353 . . . . 0.0 110.326 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' SER . . . . . 0.708 ' HA ' ' NH2' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -75.23 168.54 19.79 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 174.768 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.708 ' NH2' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -87.07 -47.29 9.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.006 0.432 . . . . 0.0 110.881 -176.082 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -100.63 -35.52 4.33 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.16 29.82 1.35 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.446 -0.377 . . . . 0.0 110.561 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.531 ' HG ' ' N ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -71.09 -41.38 70.71 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.402 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.531 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -47.31 -53.89 25.49 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.369 -175.626 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.504 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 73.9 Cg_endo -73.76 -16.73 23.44 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.076 1.851 . . . . 0.0 112.983 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.547 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -88.44 -15.74 34.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.671 0.272 . . . . 0.0 111.021 -177.809 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.887 HD21 HD21 ' A' ' 102' ' ' LEU . 6.3 tp -58.42 -53.49 57.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.176 0.512 . . . . 0.0 111.024 -178.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.47 -27.06 62.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.317 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.6 -28.79 62.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.84 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.509 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 41.2 m -77.41 -38.08 50.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.14 0.495 . . . . 0.0 109.957 178.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.24 81.25 1.58 Allowed Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.269 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.562 HD21 HD11 ' A' ' 43' ' ' ILE . 29.1 mt -122.36 148.64 44.82 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.476 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -128.06 138.93 34.0 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -70.54 -0.82 8.14 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 122.919 2.413 . . . . 0.0 114.266 -170.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.563 ' HA ' ' HG3' ' A' ' 108' ' ' LYS . 38.3 mm-40 -100.03 9.34 43.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.133 0.492 . . . . 0.0 109.997 175.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.476 ' HG3' ' OD2' ' A' ' 80' ' ' ASP . 7.2 mttm -102.82 128.11 28.58 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.235 -178.165 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.82 ' HG2' HG12 ' A' ' 40' ' ' ILE . 72.9 Cg_endo -72.96 122.06 7.81 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.409 2.072 . . . . 0.0 110.806 174.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.474 HG12 ' HB ' ' A' ' 41' ' ' THR . 1.8 m -130.56 152.62 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.029 0.443 . . . . 0.0 111.371 -173.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.607 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 1.2 p -127.07 142.49 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 16.4 m -104.33 135.82 40.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.124 0.488 . . . . 0.0 110.556 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.823 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.9 t80 -119.48 144.65 46.88 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.753 -177.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' CYS . . . . . 0.626 ' HB3' ' HB2' ' A' ' 95' ' ' ALA . 52.7 t 176.73 -73.97 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.446 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.725 ' HA ' ' HA3' ' A' ' 116' ' ' GLY . 0.6 OUTLIER -162.46 -149.91 0.16 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.423 175.777 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' THR . . . . . 0.608 ' H ' ' HD3' ' A' ' 90' ' ' LYS . 0.2 OUTLIER -109.02 28.06 8.87 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -174.037 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -127.32 -177.1 3.94 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -175.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.434 ' HA ' ' HB3' ' A' ' 96' ' ' ALA . . . -60.04 -26.52 66.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.956 -1.02 . . . . 0.0 112.667 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 0.581 ' HB3' ' S1 ' ' A' ' 138' ' ' PS5 . 1.7 ttt180 -49.47 -46.71 48.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.636 0.255 . . . . 0.0 111.618 -177.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.626 ' HB2' ' HB3' ' A' ' 89' ' ' CYS . . . -77.13 -35.41 56.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.117 0.484 . . . . 0.0 110.627 176.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' A' ' 93' ' ' ALA . . . -59.71 -27.91 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.174 -178.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.453 HD21 HD21 ' B' ' 97' ' ' LEU . 2.8 mm? -67.59 -35.27 78.67 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.407 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.73 -45.63 50.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.913 0.387 . . . . 0.0 110.427 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -70.21 -53.45 13.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.57 -177.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -62.3 -35.81 80.19 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.704 -0.292 . . . . 0.0 111.408 -174.245 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.504 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 23.4 m -70.75 -35.57 72.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.826 0.346 . . . . 0.0 110.8 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.887 HD21 HD21 ' A' ' 74' ' ' LEU . 13.1 mt -66.36 -47.77 72.35 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.84 0.352 . . . . 0.0 111.083 177.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.709 ' HB3' HG21 ' A' ' 110' ' ' ILE . 0.6 OUTLIER -67.79 -26.17 65.96 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.966 0.413 . . . . 0.0 110.356 178.535 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -8.08 32.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.395 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -108.81 -12.03 14.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.576 0.226 . . . . 0.0 111.385 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.58 18.5 4.83 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.072 -1.061 . . . . 0.0 113.343 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.443 ' CE1' HD22 ' A' ' 102' ' ' LEU . 4.2 m-85 -66.2 140.16 58.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.307 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.563 ' HG3' ' HA ' ' A' ' 82' ' ' GLU . 14.5 mtpp -62.69 -84.69 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.194 -171.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.39 109.85 19.36 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.686 -177.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.709 HG21 ' HB3' ' A' ' 103' ' ' ARG . 1.3 tt -114.71 128.74 71.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.154 0.502 . . . . 0.0 111.247 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.607 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 12.0 m-85 -113.36 139.67 48.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.433 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -115.98 144.41 44.11 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.05 130.12 34.87 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.867 -173.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.801 ' HG2' ' HG3' ' A' ' 24' ' ' MET . 0.0 OUTLIER -96.09 17.29 15.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.374 172.777 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.46 -70.63 0.12 Allowed Glycine 0 N--CA 1.442 -0.944 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.836 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.725 ' HA3' ' HA ' ' A' ' 90' ' ' LYS . . . 114.59 177.71 18.96 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.08 179.474 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' MET . . . . . 0.552 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -57.73 -37.98 74.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.822 0.344 . . . . 0.0 111.11 -178.199 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.53 -28.52 70.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.505 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -75.38 -31.95 60.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.37 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.69 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -57.24 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 62.4 mt -63.21 -37.4 87.08 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.555 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -60.23 -40.09 89.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.718 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.504 ' HB2' ' HG ' ' A' ' 125' ' ' LEU . 38.6 mm-40 -81.89 -3.08 53.3 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.251 -177.33 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.98 32.46 73.33 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.575 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 76.6 mt -78.82 163.26 61.58 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.359 -178.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.575 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 28.2 Cg_endo -57.53 113.26 1.42 Allowed 'Trans proline' 0 CA--C 1.517 -0.338 0 C-N-CA 122.824 2.35 . . . . 0.0 111.484 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.9 m -121.09 151.07 40.28 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LEU . . . . . 0.779 ' HB3' ' HE2' ' A' ' 56' ' ' LYS . 1.3 mt -98.92 101.35 12.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.838 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -122.41 144.77 48.83 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.67 103.24 0.09 Allowed 'General case' 0 C--N 1.328 -0.335 0 O-C-N 123.429 0.455 . . . . 0.0 109.858 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.41 129.69 36.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.951 -169.094 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -79.4 84.52 5.29 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.749 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.78 170.26 22.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.241 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -81.19 66.75 6.85 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -133.42 111.96 11.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.683 -172.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -84.92 170.33 13.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.397 177.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.439 -0.791 . . . . 0.0 109.967 177.973 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 120.922 0.391 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -86.6 76.58 9.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.101 0.477 . . . . 0.0 110.429 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 1.6 ttm -92.67 19.57 7.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.316 -176.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' GLY . . . . . 0.71 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -55.13 -34.96 59.02 Favored Glycine 0 C--O 1.227 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.427 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.58 -32.24 71.34 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 122.946 0.498 . . . . 0.0 111.628 176.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -72.79 -57.93 3.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.133 -174.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.71 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.3 p90 -74.75 -25.66 59.24 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.521 -176.417 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -53.71 -52.47 59.96 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 123.361 0.413 . . . . 0.0 110.553 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.81 -44.3 77.64 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.84 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -42.29 86.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -175.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' PHE . . . . . 0.403 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 0.6 OUTLIER -53.5 -43.81 68.54 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.221 0.534 . . . . 0.0 110.704 -178.699 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -24.58 65.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.258 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.66 -48.78 36.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.866 0.365 . . . . 0.0 110.81 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -67.69 -51.41 49.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.303 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.69 -34.1 41.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.935 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' LYS . . . . . 0.436 ' HE2' ' HB3' ' B' ' 16' ' ' LYS . 5.9 mtpt -66.63 -39.43 88.27 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.741 0.305 . . . . 0.0 111.16 176.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.93 -26.89 68.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.573 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.45 -33.3 64.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.116 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.658 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 0.1 OUTLIER -75.94 -21.25 57.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.125 0.488 . . . . 0.0 110.928 174.874 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.96 -19.16 61.94 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.026 -174.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.5 -1.18 57.62 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -176.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.856 ' HG3' HG23 ' B' ' 110' ' ' ILE . 1.5 mpp? -120.47 165.93 14.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.83 0.348 . . . . 0.0 111.343 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 15.4 t -80.99 103.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' MET . . . . . 0.658 ' SD ' ' HB3' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -79.14 107.21 11.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.997 0.427 . . . . 0.0 110.672 -174.912 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 25' ' ' LEU . . . . . 0.516 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.1 mt -126.73 142.08 51.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.662 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.48 151.8 85.33 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.203 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.428 ' HB2' ' CD1' ' B' ' 125' ' ' LEU . 4.7 Cg_endo -47.66 -31.33 14.14 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.854 3.036 . . . . 0.0 114.372 -177.176 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' LYS . . . . . 0.854 ' HD3' ' HG2' ' B' ' 123' ' ' GLU . 1.3 mtmm -74.43 -42.67 58.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.471 . . . . 0.0 110.791 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.94 -32.44 69.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.117 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.26 -44.05 69.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.464 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' TYR . . . . . 0.595 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.3 t80 -67.03 -30.47 70.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.204 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -57.09 -52.85 63.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.035 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.719 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -73.9 -27.75 61.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.677 178.321 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.695 HD11 ' HB2' ' B' ' 42' ' ' LEU . 1.1 mt -61.73 -55.8 26.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.945 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.06 -22.19 55.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.775 -173.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.84 -31.78 20.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.964 0.411 . . . . 0.0 110.555 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -121.3 102.94 42.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.437 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' PRO . . . . . 0.545 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 17.1 Cg_exo -68.27 5.81 1.08 Allowed 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.261 2.641 . . . . 0.0 112.545 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.83 -27.56 17.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.583 174.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.719 HD12 ' HB2' ' B' ' 33' ' ' LEU . 9.2 mt -82.37 109.2 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.688 175.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.417 HG21 ' HE2' ' B' ' 63' ' ' LYS . 1.2 m -100.25 145.22 28.35 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.672 -176.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.996 HD11 ' HB2' ' B' ' 88' ' ' PHE . 12.2 tp -101.1 122.58 43.84 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.302 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.479 HG23 ' HE3' ' B' ' 65' ' ' MET . 79.7 mt -103.85 111.16 32.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.213 176.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.833 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -98.96 129.43 45.27 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.68 96.64 4.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.366 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ARG . . . . . 0.568 ' HG2' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -155.75 167.0 31.82 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.369 -177.464 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.47 ' H ' ' HD2' ' B' ' 46' ' ' ARG . 0.7 OUTLIER -75.6 125.66 88.31 Favored Pre-proline 0 C--N 1.314 -0.941 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.125 -176.439 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 48' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' B' ' 51' ' ' LEU . 18.4 Cg_endo -65.43 -19.79 61.22 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.901 2.401 . . . . 0.0 113.472 -172.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.66 -46.15 73.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.975 0.417 . . . . 0.0 110.472 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.05 -34.07 66.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.582 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.859 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.5 OUTLIER -58.87 -45.77 89.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.467 0.651 . . . . 0.0 110.253 176.597 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -66.53 -37.01 84.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.4 -48.41 10.38 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -174.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.1 -35.79 11.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.932 -172.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 135.64 159.36 8.53 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.125 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' LYS . . . . . 0.859 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -139.49 154.99 72.04 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.882 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.06 123.23 13.36 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.278 1.986 . . . . 0.0 112.562 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -101.83 74.99 1.51 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.2 0.524 . . . . 0.0 109.954 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.593 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.1 m -115.95 167.92 8.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.837 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -41.53 99.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.942 -175.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.545 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 0.0 OUTLIER -122.49 77.34 1.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.362 0.601 . . . . 0.0 110.857 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 62' ' ' TYR . . . . . 0.833 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.2 t80 -122.57 127.8 49.91 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.749 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.417 ' HE2' HG21 ' B' ' 41' ' ' THR . 11.2 mttt -123.29 124.57 43.27 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.876 176.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -88.11 128.34 35.42 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' MET . . . . . 0.479 ' HE3' HG23 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -112.3 162.58 15.36 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 173.774 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 66' ' ' SER . . . . . 0.45 ' O ' ' HB3' ' B' ' 70' ' ' LEU . 0.9 OUTLIER -79.17 140.77 37.66 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 67' ' ' ARG . . . . . 0.524 ' H ' ' HG3' ' B' ' 67' ' ' ARG . 0.0 OUTLIER -48.72 -48.42 40.44 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.628 -173.912 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 68' ' ' GLY . . . . . 0.495 ' HA3' ' S3 ' ' A' ' 138' ' ' PS5 . . . -104.05 -44.53 1.61 Allowed Glycine 0 N--CA 1.44 -1.04 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.021 176.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 69' ' ' LYS . . . . . 0.584 ' O ' ' HD2' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -82.45 35.73 0.46 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.327 -0.436 . . . . 0.0 111.669 -175.971 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' B' ' 66' ' ' SER . 0.1 OUTLIER -74.66 -25.26 59.07 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 173.519 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.457 ' CB ' ' HD3' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -50.24 -59.47 7.06 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.399 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.594 ' HG3' ' HE2' ' A' ' 12' ' ' LYS . 3.9 Cg_exo -74.43 -15.85 22.04 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.605 2.203 . . . . 0.0 112.965 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 73' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' B' ' 73' ' ' LEU . 0.2 OUTLIER -87.19 -6.22 58.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.607 0.242 . . . . 0.0 111.504 -174.767 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.598 HD23 ' CD1' ' A' ' 7' ' ' PHE . 6.0 tp -63.98 -54.87 27.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.555 -175.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.627 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -69.73 -23.62 63.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.891 0.377 . . . . 0.0 111.399 -179.439 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.91 -31.21 61.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.796 -177.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -73.93 -39.26 63.92 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.13 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.55 81.2 1.46 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.908 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.5 mt -123.45 142.54 50.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.657 0.265 . . . . 0.0 110.93 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.514 ' OD2' ' HG2' ' B' ' 83' ' ' LYS . 0.0 OUTLIER -114.77 136.28 22.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.24 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.49 -0.37 2.93 Favored 'Trans proline' 0 N--CA 1.476 0.468 0 C-N-CA 123.078 2.519 . . . . 0.0 114.234 -172.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.444 ' HB2' ' OD2' ' B' ' 80' ' ' ASP . 3.6 mm-40 -98.73 -11.59 21.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 0.0 110.717 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' LYS . . . . . 0.514 ' HG2' ' OD2' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -82.85 122.01 77.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.626 179.028 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.547 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 15.9 Cg_exo -63.94 132.7 35.6 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.363 2.042 . . . . 0.0 110.168 173.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.516 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.0 OUTLIER -131.58 143.01 41.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 120.893 0.378 . . . . 0.0 111.124 -173.414 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.538 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 0.7 OUTLIER -121.85 139.78 47.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 175.508 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 87' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' B' ' 43' ' ' ILE . 1.3 m -102.8 126.46 57.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.074 0.464 . . . . 0.0 110.33 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.996 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.2 t80 -111.88 140.27 46.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.371 -174.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 89' ' ' CYS . . . . . 0.568 ' SG ' ' HG2' ' B' ' 46' ' ' ARG . 49.6 t 170.34 -63.92 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.866 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.557 ' HA ' ' HA2' ' B' ' 116' ' ' GLY . 0.1 OUTLIER -172.36 -167.76 0.49 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.261 -0.882 . . . . 0.0 109.173 175.708 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -36.79 60.15 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -175.233 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.6 -167.44 0.68 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -168.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.665 ' HA ' ' HB3' ' B' ' 96' ' ' ALA . . . -56.95 -26.77 60.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 114.047 -1.433 . . . . 0.0 113.645 -172.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.39 -55.0 11.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.749 0.309 . . . . 0.0 111.365 -176.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -77.9 -33.94 51.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.947 177.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' ALA . . . . . 0.665 ' HB3' ' HA ' ' B' ' 93' ' ' ALA . . . -61.72 -32.36 72.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.111 -176.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 97' ' ' LEU . . . . . 0.453 HD21 HD21 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -67.78 -39.59 84.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.799 0.333 . . . . 0.0 110.93 -178.461 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.99 -45.57 70.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.0 0.429 . . . . 0.0 110.237 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.21 -50.47 33.17 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.54 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 100' ' ' LYS . . . . . 0.596 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -60.96 -38.35 85.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -173.943 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 101' ' ' THR . . . . . 0.596 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 2.3 m -72.84 -35.91 67.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.614 0.245 . . . . 0.0 111.06 178.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 10.1 mt -62.94 -47.82 81.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.515 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 103' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -65.09 -26.75 68.36 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.906 0.384 . . . . 0.0 110.53 179.209 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -69.36 -7.45 37.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.828 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 105' ' ' TYR . . . . . 0.412 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 23.5 m-85 -103.36 -8.24 20.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 0.0 110.938 178.281 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.14 41.4 1.53 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.243 -0.979 . . . . 0.0 112.735 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -87.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.418 -175.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.17 119.62 35.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.879 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 110' ' ' ILE . . . . . 0.856 HG23 ' HG3' ' B' ' 22' ' ' MET . 1.2 tt -119.46 126.58 75.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.252 0.549 . . . . 0.0 110.818 -176.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 111' ' ' TYR . . . . . 0.538 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 3.1 m-85 -112.95 141.67 46.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.866 -174.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.421 ' HB3' ' CE ' ' B' ' 24' ' ' MET . 0.7 OUTLIER -112.26 139.51 47.74 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.301 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 113' ' ' SER . . . . . 0.516 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 0.3 OUTLIER -81.93 119.86 24.48 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -173.266 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 114' ' ' GLU . . . . . 0.562 ' CG ' ' HB3' ' B' ' 24' ' ' MET . 2.4 mm-40 -82.08 5.19 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.79 177.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -107.99 -99.06 2.59 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.012 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 116' ' ' GLY . . . . . 0.557 ' HA2' ' HA ' ' B' ' 90' ' ' LYS . . . 155.18 166.74 15.82 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 -178.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 117' ' ' MET . . . . . 0.469 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.1 OUTLIER -59.75 -39.19 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.006 0.431 . . . . 0.0 110.75 -178.208 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 118' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 18.6 p-10 -68.78 -23.85 64.35 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.83 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 119' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' B' ' 119' ' ' LYS . 0.1 OUTLIER -73.67 -32.14 63.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.883 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.683 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 27.7 t-105 -58.83 -51.46 69.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.736 177.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 11.5 mt -67.3 -40.12 86.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.144 178.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 122' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.2 OUTLIER -63.7 -45.93 87.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.665 -176.706 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 123' ' ' GLU . . . . . 0.854 ' HG2' ' HD3' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -83.69 17.05 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.646 -176.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 67.44 23.05 73.46 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.007 171.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.668 HD12 ' HA ' ' B' ' 120' ' ' TRP . 53.3 mt -75.29 154.54 86.15 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 117.101 0.451 . . . . 0.0 110.347 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -58.65 115.75 2.77 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.046 2.497 . . . . 0.0 112.219 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.17 150.59 52.0 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.181 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 128' ' ' LEU . . . . . 0.472 ' HB2' ' HG2' ' B' ' 56' ' ' LYS . 2.5 mt -83.31 101.07 11.05 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -121.17 123.61 42.69 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -86.53 79.59 8.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.965 0.412 . . . . 0.0 110.707 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.17 173.03 9.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.284 175.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -80.27 54.1 1.92 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.234 0.54 . . . . 0.0 111.119 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -94.93 126.55 40.34 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.939 174.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.23 103.12 0.45 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -143.69 110.32 5.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.625 -173.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -65.61 114.99 5.34 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.521 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.036 -0.983 . . . . 0.0 109.202 177.257 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 138' ' ' PS5 . . . . . 0.581 ' S1 ' ' HB3' ' A' ' 94' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 139' ' ' PS5 . . . . . 0.576 ' S4 ' ' HB2' ' A' ' 67' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.474 ' HA ' ' OD1' ' B' ' 80' ' ' ASP . . . . . . . . 0 N--CA 1.482 1.166 0 CA-C-O 120.718 0.294 . . . . 0.0 111.229 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.84 67.08 8.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.281 0.562 . . . . 0.0 111.352 -178.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.544 ' HG3' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -113.88 10.07 17.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.331 178.72 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.549 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -62.69 -39.8 98.38 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.783 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -65.03 -32.88 74.82 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.266 0.555 . . . . 0.0 110.289 176.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.544 ' HG3' ' HG3' ' A' ' 3' ' ' MET . 17.0 mmtt -64.78 -57.5 8.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 112.252 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.549 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.8 p90 -80.43 -26.65 38.29 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 119.788 -0.765 . . . . 0.0 112.065 -174.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . 0.449 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . 16.0 t70 -53.85 -51.18 64.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.959 0.409 . . . . 0.0 111.176 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.388 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -68.57 -40.62 80.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.932 -175.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.427 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.5 OUTLIER -57.86 -45.96 85.54 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.194 0.521 . . . . 0.0 110.293 -178.402 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.56 ' HD3' ' HG3' ' B' ' 72' ' ' PRO . 1.2 tptp -65.31 -24.98 67.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.083 175.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.18 -44.54 46.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.227 178.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -71.51 -51.3 24.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.613 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.763 HG13 ' HB2' ' A' ' 93' ' ' ALA . 2.3 t -57.24 -33.63 43.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.979 0.419 . . . . 0.0 110.869 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -37.4 70.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.356 177.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.35 -26.04 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.028 0.442 . . . . 0.0 111.551 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.04 -31.63 66.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.06 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -76.14 -22.43 55.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.42 0.628 . . . . 0.0 110.579 173.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.15 58.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.865 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -76.85 -9.12 58.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.886 -176.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -127.98 171.6 11.69 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.128 -0.357 . . . . 0.0 111.299 -177.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -84.49 109.66 18.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' MET . . . . . 0.721 ' SD ' ' HB3' ' A' ' 112' ' ' ASN . 0.6 OUTLIER -78.02 103.47 7.98 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.7 -174.739 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.596 ' O ' ' HA ' ' A' ' 113' ' ' SER . 7.5 mt -121.1 140.89 51.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.157 0.503 . . . . 0.0 111.316 -177.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 141.77 76.15 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.052 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -44.51 -30.12 3.7 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 124.203 3.269 . . . . 0.0 114.636 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.457 ' HG2' ' OE2' ' A' ' 123' ' ' GLU . 0.4 OUTLIER -73.65 -42.59 61.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.941 0.4 . . . . 0.0 111.142 178.477 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.38 -33.25 69.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.212 177.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.428 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -65.98 -47.46 74.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.082 176.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TYR . . . . . 0.617 ' HA ' HD12 ' A' ' 34' ' ' LEU . 51.6 t80 -64.2 -30.53 71.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.076 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -52.61 64.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.022 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.423 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -73.73 -27.42 61.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.886 178.758 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 31' ' ' TYR . 35.2 mt -62.32 -54.65 37.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.302 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLN . . . . . 0.448 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -76.39 -28.03 56.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.04 -174.348 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.448 ' N ' ' HG3' ' A' ' 35' ' ' GLN . 17.7 mt-10 -79.74 -34.13 40.23 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.222 0.534 . . . . 0.0 110.426 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -117.53 94.58 45.92 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.718 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -60.87 -2.83 2.36 Favored 'Trans proline' 0 N--CA 1.474 0.381 0 C-N-CA 123.201 2.6 . . . . 0.0 113.921 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -96.98 -18.92 19.13 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.955 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.502 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 23.5 mt -77.25 108.59 10.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.487 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -100.33 145.2 28.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.515 -173.979 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.744 HD11 ' HB2' ' A' ' 88' ' ' PHE . 7.8 tp -103.85 129.2 51.29 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.3 mp -112.7 121.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.091 0.472 . . . . 0.0 109.876 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.822 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -98.38 138.87 34.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.844 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.97 95.33 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.489 0.662 . . . . 0.0 109.462 174.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 1.107 ' HA ' HH21 ' A' ' 94' ' ' ARG . 1.8 tpt85 -152.24 163.85 38.57 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.274 -0.876 . . . . 0.0 108.774 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.49 139.92 31.81 Favored Pre-proline 0 C--N 1.322 -0.61 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.15 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -62.09 -19.32 65.97 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.322 2.681 . . . . 0.0 115.059 -166.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.461 ' HB2' ' OE2' ' B' ' 50' ' ' GLU . 0.1 OUTLIER -76.7 -39.2 52.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.041 -0.664 . . . . 0.0 111.386 -178.927 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.19 -37.55 66.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.602 HD13 ' HB3' ' A' ' 46' ' ' ARG . 0.8 OUTLIER -59.34 -45.84 90.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.234 0.54 . . . . 0.0 110.912 177.327 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -35.52 80.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.85 -177.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.87 -48.52 12.26 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -175.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -92.62 -36.79 12.79 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.578 -0.449 . . . . 0.0 112.199 -173.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.3 173.19 13.51 Favored Glycine 0 N--CA 1.44 -1.097 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.819 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . 0.566 ' HB2' ' HD2' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -149.04 165.7 17.09 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.729 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.566 ' HD2' ' HB2' ' A' ' 56' ' ' LYS . 18.6 Cg_endo -63.78 123.63 12.3 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 121.881 1.72 . . . . 0.0 112.387 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -94.16 71.97 3.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.072 0.463 . . . . 0.0 110.044 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.5 m -115.94 174.41 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.34 -24.27 32.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.812 0.339 . . . . 0.0 111.383 -176.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -125.43 66.45 1.15 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.384 0.612 . . . . 0.0 111.335 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.822 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 0.8 OUTLIER -132.84 139.13 47.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.623 177.332 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.487 ' HE2' HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -135.36 135.72 40.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.975 0.417 . . . . 0.0 110.533 176.399 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.0 t-160 -93.18 115.63 28.25 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.493 178.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.4 171.24 7.88 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 178.391 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.27 170.57 14.73 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 175.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.495 ' HB2' ' S4 ' ' B' ' 139' ' ' PS5 . 0.3 OUTLIER -94.23 -44.9 7.75 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.021 -175.858 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.423 ' HA3' ' HB2' ' B' ' 92' ' ' ALA . . . -102.43 -45.33 1.7 Allowed Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.81 -0.71 . . . . 0.0 111.499 175.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.436 ' O ' ' HD2' ' A' ' 72' ' ' PRO . 3.6 mttm -89.11 35.4 0.8 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.301 -0.45 . . . . 0.0 110.619 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.487 ' HG ' ' N ' ' A' ' 71' ' ' GLU . 0.2 OUTLIER -68.02 -35.09 77.72 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.56 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.962 ' HB3' ' HB3' ' B' ' 11' ' ' PHE . 0.0 OUTLIER -45.01 -57.62 6.85 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.757 -174.603 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.519 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 74.0 Cg_endo -73.65 -15.87 24.14 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.051 1.834 . . . . 0.0 112.605 178.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.467 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -81.29 -22.32 38.68 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.283 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.685 HD21 HD21 ' A' ' 102' ' ' LEU . 3.7 tp -58.31 -53.16 61.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.137 177.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.01 -27.38 68.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.585 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.91 -22.54 39.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.755 0.312 . . . . 0.0 111.235 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' SER . . . . . 0.465 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 49.8 m -79.57 -35.82 39.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.9 -177.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.18 63.39 1.04 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.521 -0.847 . . . . 0.0 111.869 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.7 mt -110.45 136.67 49.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.574 0.226 . . . . 0.0 110.408 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASP . . . . . 0.503 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -121.52 138.81 28.81 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.238 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' B' ' 1' ' ' ALA . 31.9 Cg_endo -68.56 8.01 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.903 2.402 . . . . 0.0 113.719 -174.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -102.27 -17.44 15.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 122.106 -0.371 . . . . 0.0 110.616 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.503 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -93.69 126.19 50.64 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.684 178.499 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.621 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 18.1 Cg_exo -65.36 143.75 77.68 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.769 2.313 . . . . 0.0 111.362 177.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.509 HG23 HD12 ' A' ' 110' ' ' ILE . 2.4 m -137.72 149.65 25.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.076 0.465 . . . . 0.0 111.046 -178.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.564 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 0.7 OUTLIER -125.74 142.91 41.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.488 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.447 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 2.9 m -103.4 134.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.951 0.405 . . . . 0.0 110.608 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' PHE . . . . . 0.744 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -120.12 141.47 49.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.939 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 46.8 t -173.39 -76.81 0.01 OUTLIER 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.887 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.85 ' HA ' ' HA3' ' A' ' 116' ' ' GLY . 0.0 OUTLIER -172.1 -175.44 1.45 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.443 177.332 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.94 65.53 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 123.393 0.433 . . . . 0.0 111.209 179.239 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.644 ' HB1' ' HA3' ' B' ' 68' ' ' GLY . . . -153.03 176.5 11.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.162 0.506 . . . . 0.0 112.228 -173.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.763 ' HB2' HG13 ' A' ' 15' ' ' VAL . . . -74.28 -25.0 59.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.069 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ARG . . . . . 1.107 HH21 ' HA ' ' A' ' 46' ' ' ARG . 1.7 ttt180 -43.77 -51.0 7.56 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -173.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.447 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . -68.74 -31.3 70.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.971 0.415 . . . . 0.0 111.299 -178.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -28.56 69.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.287 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.74 -38.89 92.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.695 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.9 -46.76 33.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.693 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -65.46 -55.48 20.47 Favored Glycine 0 CA--C 1.519 0.299 0 C-N-CA 121.058 -0.591 . . . . 0.0 113.57 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.551 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -61.86 -32.86 73.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.813 0.34 . . . . 0.0 111.199 -174.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.479 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 44.1 m -72.88 -38.74 66.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.782 0.325 . . . . 0.0 110.974 177.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.685 HD21 HD21 ' A' ' 74' ' ' LEU . 11.6 mt -64.3 -45.2 89.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.47 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.1 -27.47 68.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.919 0.39 . . . . 0.0 110.597 179.157 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.19 -6.73 41.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.368 178.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' TYR . . . . . 0.454 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 22.6 m-85 -104.21 -5.42 21.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.784 0.326 . . . . 0.0 110.543 176.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 107.07 34.61 2.93 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.952 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -78.23 139.27 38.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.682 0.277 . . . . 0.0 110.44 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -60.85 3.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.751 -172.248 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.621 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -139.23 120.01 14.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.294 -178.573 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.546 HG21 ' HB3' ' A' ' 103' ' ' ARG . 0.7 OUTLIER -121.37 127.16 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.23 0.538 . . . . 0.0 111.397 -176.712 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.564 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 1.9 m-85 -118.52 145.76 45.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.261 -176.118 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASN . . . . . 0.721 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 38.4 t-20 -117.12 143.41 45.84 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . 0.596 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -97.23 115.46 27.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -172.851 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLU . . . . . 0.471 ' HG3' ' HB3' ' A' ' 24' ' ' MET . 2.9 mm-40 -76.32 33.96 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -139.84 -78.44 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.315 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLY . . . . . 0.85 ' HA3' ' HA ' ' A' ' 90' ' ' LYS . . . 114.02 178.8 19.14 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.548 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' MET . . . . . 0.432 ' SD ' ' HD3' ' A' ' 57' ' ' PRO . 10.4 tpp -53.61 -38.49 64.07 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.017 0.437 . . . . 0.0 111.178 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -58.48 -41.66 85.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.573 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.8 -32.66 63.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.355 179.598 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.612 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -61.11 -53.66 54.26 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 9.1 mt -63.68 -42.19 98.06 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.109 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.41 -41.49 93.53 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.804 -177.462 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . 0.564 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -67.08 -21.2 65.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.913 0.387 . . . . 0.0 110.972 -177.343 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 90.5 21.87 36.14 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.883 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.564 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 24.3 mt -75.97 159.53 80.54 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 177.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.493 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 14.4 Cg_endo -54.17 114.03 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.973 2.449 . . . . 0.0 111.704 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.05 148.78 41.93 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 120.991 0.424 . . . . 0.0 110.698 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.5 mt -97.02 100.77 12.26 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.96 158.82 43.86 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -175.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.87 68.8 4.0 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.024 0.44 . . . . 0.0 111.039 -176.077 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.97 158.12 37.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.925 177.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -78.6 60.48 2.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.967 0.413 . . . . 0.0 111.814 -175.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -128.64 148.28 50.79 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 172.085 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -76.5 92.58 3.44 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.413 0.625 . . . . 0.0 110.909 -175.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -139.61 136.41 34.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.287 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -136.99 164.74 27.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 118.211 -0.9 . . . . 0.0 109.924 178.779 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ALA . . . . . 0.509 ' O ' ' HD2' ' A' ' 81' ' ' PRO . . . . . . . . 0 N--CA 1.474 0.769 0 CA-C-O 120.91 0.386 . . . . 0.0 110.119 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.95 80.78 4.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.24 0.543 . . . . 0.0 110.138 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' MET . . . . . 0.437 ' HG2' ' HG3' ' B' ' 6' ' ' LYS . 14.1 mtp -101.75 33.04 3.14 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.374 -173.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' GLY . . . . . 0.596 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.49 -35.03 78.04 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.319 -0.467 . . . . 0.0 113.434 -177.625 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.83 -31.88 66.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.012 0.434 . . . . 0.0 110.561 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LYS . . . . . 0.503 ' HD3' ' HA ' ' B' ' 6' ' ' LYS . 6.2 mmtt -71.31 -57.8 4.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.134 -173.229 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.596 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.6 p90 -73.01 -35.59 66.84 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.103 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.33 -56.08 22.1 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.83 0.348 . . . . 0.0 110.877 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.08 -46.55 85.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.801 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.53 -41.87 92.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.536 -177.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' PHE . . . . . 0.962 ' HB3' ' HB3' ' A' ' 71' ' ' GLU . 0.3 OUTLIER -54.11 -43.89 70.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.217 0.532 . . . . 0.0 110.525 -178.045 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -65.24 -24.43 67.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.619 177.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.41 -49.78 21.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.38 . . . . 0.0 110.853 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' GLN . . . . . 0.405 ' OE1' HG23 ' A' ' 101' ' ' THR . 65.2 mt-30 -71.33 -52.0 21.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.896 -178.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.625 HG22 ' HB2' ' B' ' 93' ' ' ALA . 0.8 OUTLIER -56.29 -33.47 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.146 -177.551 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -70.94 -34.92 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.2 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -26.74 68.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.934 0.397 . . . . 0.0 111.065 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.17 72.03 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.631 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' LYS . . . . . 0.532 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 6.9 mtmt -76.07 -22.38 55.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.351 0.596 . . . . 0.0 111.008 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.28 -19.02 61.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.122 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.62 -5.46 56.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.527 -177.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' MET . . . . . 0.924 ' HG3' HG23 ' B' ' 110' ' ' ILE . 1.5 mpp? -122.16 176.33 5.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.567 0.222 . . . . 0.0 110.79 -179.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 31.5 t -88.37 105.03 15.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' MET . . . . . 0.532 ' SD ' ' HB3' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -75.68 111.28 10.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.998 0.428 . . . . 0.0 110.767 -175.223 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 25' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' B' ' 25' ' ' LEU . 5.2 mt -124.17 144.29 50.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.081 -176.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.15 146.04 61.97 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.547 176.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -51.52 -21.56 10.84 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.522 2.815 . . . . 0.0 114.104 -175.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -75.03 -47.45 28.95 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.053 0.454 . . . . 0.0 110.821 175.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.02 -32.63 72.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.82 -47.79 61.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.967 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' TYR . . . . . 0.512 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 86.2 t80 -67.02 -29.73 69.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.748 178.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.96 -53.51 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.82 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -74.08 -27.59 60.97 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.01 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.607 HD11 ' HB2' ' B' ' 42' ' ' LEU . 0.2 OUTLIER -62.53 -45.84 91.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.136 178.454 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -75.87 -26.99 57.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.487 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 -29.43 26.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.813 0.339 . . . . 0.0 110.771 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -125.68 98.73 33.77 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.268 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.64 2.74 1.8 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.13 2.554 . . . . 0.0 112.871 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -90.33 -20.77 22.51 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ILE . . . . . 0.582 HG12 ' HB2' ' B' ' 84' ' ' PRO . 41.1 mt -80.22 112.52 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.123 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' THR . . . . . 0.561 ' HB ' HG12 ' B' ' 85' ' ' VAL . 1.9 m -94.72 140.64 29.62 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.057 -178.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.845 HD11 ' HB2' ' B' ' 88' ' ' PHE . 8.0 tp -105.12 123.82 48.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' ILE . . . . . 0.417 ' HA ' ' O ' ' B' ' 63' ' ' LYS . 2.1 mp -110.29 115.53 49.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.573 177.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ASP . . . . . 0.809 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.3 OUTLIER -99.06 140.51 33.11 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.553 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.87 94.7 2.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.655 0.741 . . . . 0.0 109.84 174.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ARG . . . . . 0.712 ' HG2' HH21 ' B' ' 94' ' ' ARG . 21.0 mtp85 -145.44 164.18 32.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.362 178.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.493 ' OD1' ' HD3' ' B' ' 67' ' ' ARG . 5.7 m-20 -73.28 134.25 80.27 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.242 -173.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -65.05 -21.39 63.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.449 2.766 . . . . 0.0 114.621 -169.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.35 -31.31 48.5 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.251 -0.579 . . . . 0.0 110.268 177.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 50' ' ' GLU . . . . . 0.461 ' OE2' ' HB2' ' A' ' 49' ' ' ASP . 2.3 mm-40 -70.91 -40.88 71.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.046 173.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.778 HD23 ' HD3' ' B' ' 56' ' ' LYS . 0.5 OUTLIER -60.2 -33.57 72.42 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.605 176.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -39.12 54.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.512 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.47 -46.83 13.98 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 4.1 mtm -97.65 -35.06 10.71 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.716 -0.393 . . . . 0.0 111.5 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.42 173.17 14.2 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.262 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' LYS . . . . . 0.778 ' HD3' HD23 ' B' ' 51' ' ' LEU . 0.0 OUTLIER -138.82 156.73 72.65 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.401 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 57' ' ' PRO . . . . . 0.487 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 16.4 Cg_endo -60.8 125.21 16.64 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.647 2.231 . . . . 0.0 112.956 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' ASP . . . . . 0.791 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 17.7 t0 -97.5 96.3 8.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.236 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' VAL . . . . . 0.684 HG22 ' HB2' ' B' ' 62' ' ' TYR . 34.9 m -130.89 164.65 33.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.302 176.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -38.95 77.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.564 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -124.6 75.89 1.45 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.14 0.495 . . . . 0.0 110.851 -177.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' TYR . . . . . 0.809 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 13.5 t80 -118.08 126.02 51.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.451 -178.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 43' ' ' ILE . 15.4 mttm -128.04 120.48 27.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.964 0.412 . . . . 0.0 110.346 178.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' HIS . . . . . 0.481 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 11.5 t-160 -95.83 114.2 25.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' MET . . . . . 0.443 ' SD ' ' HA ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER -96.22 170.73 9.05 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 177.887 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 66' ' ' SER . . . . . 0.504 ' HB3' ' S5 ' ' A' ' 138' ' ' PS5 . 0.3 OUTLIER -70.87 141.87 51.22 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 172.134 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 67' ' ' ARG . . . . . 0.493 ' HD3' ' OD1' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -63.43 -40.71 97.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.022 0.439 . . . . 0.0 111.697 -172.13 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 68' ' ' GLY . . . . . 0.644 ' HA3' ' HB1' ' A' ' 92' ' ' ALA . . . -103.34 -45.66 1.54 Allowed Glycine 0 N--CA 1.44 -1.05 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.435 176.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.47 39.27 0.72 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.333 -0.433 . . . . 0.0 110.776 -179.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' LEU . . . . . 0.53 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER -73.74 -31.92 63.6 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 175.718 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 71' ' ' GLU . . . . . 0.53 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.3 -60.32 4.21 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.295 -175.908 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 72' ' ' PRO . . . . . 0.56 ' HG3' ' HD3' ' A' ' 12' ' ' LYS . 3.5 Cg_exo -74.66 -16.36 21.16 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.692 2.261 . . . . 0.0 112.916 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -91.11 -21.74 21.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.678 0.275 . . . . 0.0 111.458 -174.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' LEU . . . . . 0.711 HD21 HD21 ' B' ' 102' ' ' LEU . 3.4 tp -61.02 -51.27 69.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.607 -173.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' ALA . . . . . 0.449 ' CB ' ' HB2' ' A' ' 8' ' ' ASP . . . -74.1 -17.49 60.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -76.15 -24.7 54.84 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -176.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.64 -28.0 51.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.8 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.67 83.41 1.56 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.303 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.0 mt -126.0 144.68 50.61 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.199 -0.296 . . . . 0.0 110.199 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' ASP . . . . . 0.474 ' OD1' ' HA ' ' A' ' 1' ' ' ALA . 16.2 t70 -114.11 130.51 23.85 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 81' ' ' PRO . . . . . 0.651 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 33.8 Cg_endo -68.47 -6.81 18.55 Favored 'Trans proline' 0 N--CA 1.472 0.255 0 C-N-CA 122.921 2.414 . . . . 0.0 113.912 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -98.95 2.58 46.57 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.42 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' B' ' 83' ' ' LYS . 33.3 mmtm -106.76 142.66 25.44 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.132 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 84' ' ' PRO . . . . . 0.582 ' HB2' HG12 ' B' ' 40' ' ' ILE . 16.9 Cg_exo -69.35 134.71 29.53 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.545 2.163 . . . . 0.0 111.859 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 85' ' ' VAL . . . . . 0.561 HG12 ' HB ' ' B' ' 41' ' ' THR . 5.6 m -135.65 147.91 28.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.39 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 86' ' ' VAL . . . . . 0.557 HG13 HD12 ' B' ' 42' ' ' LEU . 0.5 OUTLIER -126.5 141.42 46.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.784 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 m -103.28 122.1 55.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.057 0.456 . . . . 0.0 110.062 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' PHE . . . . . 0.845 ' HB2' HD11 ' B' ' 42' ' ' LEU . 7.3 t80 -110.28 143.87 39.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.702 -175.253 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 53.4 t 178.78 -67.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.92 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.719 ' HA ' ' HA2' ' B' ' 116' ' ' GLY . 0.0 OUTLIER -176.9 -173.79 0.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.197 179.533 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -80.16 61.86 4.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.838 0.352 . . . . 0.0 110.269 175.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 92' ' ' ALA . . . . . 0.423 ' HB2' ' HA3' ' A' ' 68' ' ' GLY . . . -137.89 167.17 22.31 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.23 0.538 . . . . 0.0 112.136 -172.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 93' ' ' ALA . . . . . 0.625 ' HB2' HG22 ' B' ' 15' ' ' VAL . . . -69.48 -26.02 64.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.079 177.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 94' ' ' ARG . . . . . 0.712 HH21 ' HG2' ' B' ' 46' ' ' ARG . 0.8 OUTLIER -47.85 -49.8 28.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.693 -178.213 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.14 -36.2 66.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.932 0.396 . . . . 0.0 110.812 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 96' ' ' ALA . . . . . 0.408 ' N ' HD21 ' B' ' 112' ' ' ASN . . . -60.97 -28.99 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.513 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -40.4 90.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.965 0.412 . . . . 0.0 110.502 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 98' ' ' ALA . . . . . 0.427 ' HA ' ' HZ ' ' A' ' 11' ' ' PHE . . . -70.37 -40.42 74.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.72 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 99' ' ' GLY . . . . . 0.448 ' HA2' HD11 ' B' ' 110' ' ' ILE . . . -76.92 -49.87 7.36 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.799 -0.715 . . . . 0.0 113.615 -176.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 100' ' ' LYS . . . . . 0.601 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -64.79 -30.14 71.14 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.558 -0.378 . . . . 0.0 111.873 -172.238 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 3.2 m -72.03 -35.9 69.52 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.12 0.486 . . . . 0.0 110.163 175.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 102' ' ' LEU . . . . . 0.711 HD21 HD21 ' B' ' 74' ' ' LEU . 9.2 mt -67.1 -42.69 84.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.736 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 103' ' ' ARG . . . . . 0.601 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -62.25 -27.28 68.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.986 0.422 . . . . 0.0 110.497 179.799 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -6.75 42.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.736 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -104.38 -7.99 19.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.836 0.351 . . . . 0.0 110.634 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 111.52 15.28 10.49 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.655 175.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' PHE . . . . . 0.651 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 6.7 m-85 -61.88 125.79 25.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.793 0.33 . . . . 0.0 110.495 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -76.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.077 -172.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' THR . . . . . 0.553 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -117.33 104.4 11.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.523 -174.172 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 110' ' ' ILE . . . . . 0.924 HG23 ' HG3' ' B' ' 22' ' ' MET . 1.5 tt -114.97 125.75 72.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.164 0.507 . . . . 0.0 110.967 -176.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 111' ' ' TYR . . . . . 0.465 ' CD1' ' HB ' ' B' ' 86' ' ' VAL . 1.1 m-85 -115.3 143.79 44.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.776 -175.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 112' ' ' ASN . . . . . 0.408 HD21 ' N ' ' B' ' 96' ' ' ALA . 0.7 OUTLIER -114.28 143.34 45.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.56 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 88.7 p -79.74 129.09 34.18 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.839 0.352 . . . . 0.0 111.53 -172.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -97.61 8.18 45.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.082 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -122.3 -96.16 1.33 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.741 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 116' ' ' GLY . . . . . 0.719 ' HA2' ' HA ' ' B' ' 90' ' ' LYS . . . 156.64 172.81 24.37 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.007 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 117' ' ' MET . . . . . 0.654 ' SD ' ' HD3' ' B' ' 46' ' ' ARG . 36.1 ttm -62.25 -35.38 78.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.08 0.467 . . . . 0.0 110.22 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -33.56 74.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.194 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.01 -33.81 66.0 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.035 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 120' ' ' TRP . . . . . 0.65 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.6 t-105 -58.68 -51.9 67.97 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 18.7 mt -62.93 -40.01 96.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.992 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.71 -43.33 80.3 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.335 -175.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.4 0.87 10.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.663 0.268 . . . . 0.0 111.244 -176.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 76.74 24.43 67.29 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.043 -0.598 . . . . 0.0 112.337 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 125' ' ' LEU . . . . . 0.524 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 77.6 mt -77.39 161.29 73.06 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 126' ' ' PRO . . . . . 0.524 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 38.2 Cg_endo -66.86 129.86 21.82 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.781 2.321 . . . . 0.0 112.29 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.74 148.73 52.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.814 0.34 . . . . 0.0 110.773 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 128' ' ' LEU . . . . . 0.791 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.7 mt -95.69 105.98 18.04 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 175.478 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.14 158.38 44.56 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.806 -178.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -81.18 70.73 8.09 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.026 0.441 . . . . 0.0 110.109 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.59 156.27 33.25 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.281 -176.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.65 25.17 0.26 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.62 -178.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -77.75 -17.42 57.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.722 -0.217 . . . . 0.0 110.829 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.75 70.61 0.44 Allowed 'General case' 0 C--O 1.234 0.242 0 O-C-N 123.731 0.645 . . . . 0.0 110.475 -178.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -118.48 108.48 15.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.651 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -69.1 134.22 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.193 0.521 . . . . 0.0 111.007 -176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.207 -0.901 . . . . 0.0 109.824 -179.167 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 138' ' ' PS5 . . . . . 0.504 ' S5 ' ' HB3' ' B' ' 66' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 139' ' ' PS5 . . . . . 0.495 ' S4 ' ' HB2' ' A' ' 67' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.559 ' SD ' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.178 0 N-CA-C 112.03 0.382 . . . . 0.0 112.03 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.653 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -58.95 -38.32 92.55 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.961 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -71.42 -38.67 71.39 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.985 0.421 . . . . 0.0 110.488 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.559 ' HG3' ' SD ' ' A' ' 3' ' ' MET . 7.7 mmtt -60.54 -56.37 22.2 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.534 -176.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.653 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 1.1 p90 -76.46 -21.96 55.19 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 119.89 -0.724 . . . . 0.0 111.793 -175.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.713 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 0.0 OUTLIER -52.45 -46.11 66.34 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 123.447 0.467 . . . . 0.0 111.013 -178.103 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.43 -42.03 81.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.342 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.489 ' HB ' ' CE1' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -67.61 -43.13 81.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.287 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.503 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.6 OUTLIER -57.69 -44.45 85.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.301 179.282 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.661 ' HD2' ' HG3' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -66.46 -26.52 67.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.373 178.117 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.86 -42.37 63.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.078 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.0 -51.03 23.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.173 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.77 -38.37 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.237 -173.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.661 ' HG3' ' HD2' ' A' ' 12' ' ' LYS . 0.9 OUTLIER -69.55 -32.62 71.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 0.0 111.368 -177.808 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.24 -26.12 66.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.384 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.38 -36.11 80.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.136 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.03 -22.28 49.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.288 0.566 . . . . 0.0 110.962 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.43 -19.13 50.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.544 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.78 -33.81 75.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.12 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.684 ' HB3' ' HD3' ' A' ' 103' ' ' ARG . 8.6 ptm -116.99 -172.61 2.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.211 0.529 . . . . 0.0 112.274 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.6 t -79.84 112.96 18.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.272 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 120.97 29.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.019 0.437 . . . . 0.0 110.491 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 25' ' ' LEU . 2.3 mt -118.2 -168.47 1.53 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.902 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -126.61 144.13 48.7 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 173.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.423 ' HB2' ' CD1' ' A' ' 125' ' ' LEU . 1.2 Cg_endo -46.77 -30.37 9.19 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 123.933 3.089 . . . . 0.0 114.209 -174.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm -75.02 -43.8 51.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.943 0.401 . . . . 0.0 110.792 176.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.2 -32.24 73.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.393 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.639 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.01 -47.97 40.42 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.78 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.708 ' HA ' HD12 ' A' ' 34' ' ' LEU . 83.9 t80 -62.97 -33.41 75.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.862 178.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -53.9 -52.57 60.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.187 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.502 HD13 HG21 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -74.05 -26.18 60.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.364 179.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.708 HD12 ' HA ' ' A' ' 31' ' ' TYR . 99.0 mt -65.64 -48.77 71.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 111.275 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -75.69 -28.55 58.69 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.707 -174.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -86.59 -37.02 18.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.11 0.481 . . . . 0.0 110.511 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -116.48 97.43 50.0 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.77 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.566 ' HA ' ' ND2' ' A' ' 61' ' ' ASN . 35.7 Cg_endo -67.02 3.73 1.45 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 122.912 2.408 . . . . 0.0 112.902 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -91.38 -27.94 18.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.015 0.436 . . . . 0.0 110.24 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.508 HG12 ' HG2' ' A' ' 84' ' ' PRO . 25.0 mt -81.88 109.74 16.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.817 175.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.675 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -99.08 145.65 26.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.697 -175.16 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.651 HD11 ' HB2' ' A' ' 88' ' ' PHE . 2.7 tp -101.44 133.26 46.34 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.6 mt -112.77 117.1 54.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.529 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.856 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.1 OUTLIER -99.21 138.38 36.4 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.666 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.17 98.73 5.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.534 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.797 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -156.76 162.89 39.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.445 178.551 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.797 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 3.4 m-20 -80.68 157.97 71.45 Favored Pre-proline 0 C--N 1.318 -0.777 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.162 -174.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 36.6 Cg_endo -72.1 -23.1 21.83 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.859 2.373 . . . . 0.0 114.758 -170.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.454 ' HB2' ' HG3' ' B' ' 50' ' ' GLU . 3.7 t70 -78.14 -37.86 45.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.704 -0.798 . . . . 0.0 111.763 -177.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 46' ' ' ARG . 1.4 tt0 -70.53 -39.28 74.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.749 175.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.845 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 mp -59.56 -34.8 73.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.293 177.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -78.94 -45.13 21.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.164 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.54 -47.97 13.43 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 6.4 mmm -98.63 -36.25 9.94 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.629 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 173.3 14.15 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.536 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.845 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -143.64 162.28 42.42 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.199 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.46 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.5 Cg_endo -59.53 133.34 51.2 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.391 2.061 . . . . 0.0 113.156 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -95.9 95.36 8.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.063 174.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 1.048 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -129.88 145.08 36.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.289 -178.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.84 95.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.308 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.675 ' HB2' HG23 ' A' ' 41' ' ' THR . 0.8 OUTLIER -110.89 76.8 1.0 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.255 -178.566 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 1.048 ' HB2' HG23 ' A' ' 59' ' ' VAL . 4.9 t80 -120.34 125.92 49.22 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.162 -171.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.461 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 2.6 mtmt -122.88 113.12 18.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 174.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 62' ' ' TYR . 11.5 t-160 -92.39 113.08 25.25 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.993 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.665 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.744 -174.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.634 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.2 OUTLIER -45.88 -63.94 1.1 Allowed Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.622 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.634 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 7.7 Cg_exo -74.49 -16.11 21.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.4 2.066 . . . . 0.0 113.159 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.801 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.8 OUTLIER -90.71 -15.66 29.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.33 -175.255 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.681 HD13 HD11 ' A' ' 70' ' ' LEU . 42.8 tp -57.13 -53.28 59.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.3 0.571 . . . . 0.0 110.729 -178.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.439 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -69.39 -22.6 63.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.357 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 4.3 mttm -73.8 -30.12 62.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.765 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.461 ' HB2' ' HD2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -78.18 -37.36 45.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.94 0.4 . . . . 0.0 110.449 -178.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.98 86.8 1.97 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.627 -176.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.48 145.12 51.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.872 0.368 . . . . 0.0 111.097 -177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.41 ' OD1' ' HD2' ' A' ' 81' ' ' PRO . 3.1 t0 -129.15 146.58 61.39 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 40.9 Cg_endo -69.77 9.19 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.987 2.458 . . . . 0.0 113.872 -175.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.49 18.61 15.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.322 0.582 . . . . 0.0 110.004 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -111.63 127.37 26.98 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.442 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.508 ' HG2' HG12 ' A' ' 40' ' ' ILE . 5.9 Cg_exo -75.57 129.35 11.76 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.426 2.084 . . . . 0.0 111.172 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.502 HG23 HD12 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -139.11 151.04 23.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.053 -177.183 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.8 p -127.32 144.83 36.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.558 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 8.2 m -112.15 142.24 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.734 0.302 . . . . 0.0 110.725 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.769 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.0 OUTLIER -108.69 158.2 17.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.495 -178.667 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' CYS . . . . . 0.422 ' SG ' ' HG2' ' A' ' 46' ' ' ARG . 1.0 OUTLIER . . . . . 0 N--CA 1.47 0.562 0 CA-C-O 121.417 0.627 . . . . 0.0 111.481 179.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.558 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.519 -0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 109.908 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -33.49 70.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.712 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -74.23 -30.39 62.15 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.34 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.84 -40.73 54.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.745 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.47 -46.12 3.31 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.518 -0.849 . . . . 0.0 113.598 -172.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.41 -24.24 67.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.705 0.288 . . . . 0.0 111.227 -174.29 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.43 -49.65 66.01 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.442 175.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 74' ' ' LEU . 39.4 mt -58.48 -41.95 86.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.446 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.684 ' HD3' ' HB3' ' A' ' 22' ' ' MET . 0.0 OUTLIER -71.53 -27.12 62.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 0.0 110.578 177.356 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.38 -9.35 58.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.705 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.483 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 19.4 m-85 -100.24 -40.86 7.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 144.56 41.13 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.259 175.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.438 ' CE1' HD22 ' A' ' 102' ' ' LEU . 4.0 m-85 -88.05 138.76 31.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.931 0.366 . . . . 0.0 110.367 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -61.32 -72.83 0.11 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.874 -174.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.86 107.44 10.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.064 0.459 . . . . 0.0 111.247 -176.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.502 HD12 HG23 ' A' ' 85' ' ' VAL . 1.2 tt -117.61 132.73 66.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.566 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -115.0 146.09 41.59 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.578 -177.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.407 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 5.7 t-20 -113.21 141.33 47.09 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 172.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -96.31 111.71 23.69 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.732 0.301 . . . . 0.0 111.806 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 115' ' ' GLY . 1.8 tp10 -62.05 149.7 40.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.099 177.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.621 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 89.86 -108.4 3.51 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.583 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.53 -161.46 32.68 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' MET . . . . . 0.434 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 35.9 tpp -60.5 -32.65 71.65 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.042 0.448 . . . . 0.0 110.725 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -61.79 -33.91 74.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.268 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.621 ' HD3' ' HA3' ' A' ' 115' ' ' GLY . 0.0 OUTLIER -73.85 -33.13 63.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 111.42 0.155 . . . . 0.0 111.42 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.769 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -62.77 -54.04 45.11 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 15.6 mt -62.12 -43.81 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.378 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -74.79 -33.42 62.25 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -172.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -76.94 3.24 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 122.269 -0.269 . . . . 0.0 111.669 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.11 18.55 74.33 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.359 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 120' ' ' TRP . 86.8 mt -76.52 154.24 83.75 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-O 120.834 0.349 . . . . 0.0 110.552 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.481 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 26.4 Cg_endo -57.98 111.25 0.79 Allowed 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 123.066 2.511 . . . . 0.0 111.951 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.84 146.97 47.08 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.88 101.55 13.24 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.316 -0.872 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.915 -175.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' MET . . . . . 0.604 ' SD ' ' HG3' ' B' ' 6' ' ' LYS . 4.8 tpp . . . . . 0 CA--C 1.518 -0.256 0 CA-C-O 120.948 0.404 . . . . 0.0 110.066 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' GLY . . . . . 0.756 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.05 -49.19 81.11 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.599 -0.728 . . . . 0.0 113.276 -177.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -31.91 68.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.064 0.459 . . . . 0.0 111.117 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.604 ' HG3' ' SD ' ' B' ' 3' ' ' MET . 15.0 mmtp -75.57 -57.99 3.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.406 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.756 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -79.23 -23.6 43.63 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.858 -0.737 . . . . 0.0 112.485 -174.489 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . 0.439 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 17.8 t0 -53.82 -42.45 68.44 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.996 0.427 . . . . 0.0 110.536 -178.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.44 -35.34 68.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.307 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.06 -47.53 68.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.458 0.171 . . . . 0.0 111.417 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' PHE . . . . . 0.568 ' CD2' HD22 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -57.23 -38.47 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.29 0.567 . . . . 0.0 110.317 179.563 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.1 OUTLIER -68.08 -27.06 66.16 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.371 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.91 -44.29 49.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -69.74 -50.59 41.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.29 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.582 HG11 ' HG2' ' A' ' 71' ' ' GLU . 0.9 OUTLIER -61.57 -33.27 56.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.304 -178.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.575 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -71.69 -33.73 69.06 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.423 179.485 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.54 64.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.122 0.486 . . . . 0.0 110.888 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.73 -32.84 70.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.061 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.39 -24.2 42.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.06 0.457 . . . . 0.0 111.024 173.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.38 -26.19 46.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.057 -176.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.574 ' O ' ' HD3' ' B' ' 103' ' ' ARG . 3.8 t0 -85.86 21.03 2.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.659 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 9.7 mtp -143.38 156.03 44.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.468 -178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 61.2 t -81.76 100.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' MET . . . . . 0.408 ' SD ' ' HG2' ' B' ' 114' ' ' GLU . 0.0 OUTLIER -74.67 112.85 11.28 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.168 0.509 . . . . 0.0 111.111 -174.75 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . 0.47 HD23 ' HA ' ' B' ' 25' ' ' LEU . 2.5 mt -123.76 144.81 49.46 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.198 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 141.71 49.18 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.203 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.441 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 1.6 Cg_endo -46.77 -24.17 2.86 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.404 3.403 . . . . 0.0 115.083 -174.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -74.43 -43.78 54.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.0 0.428 . . . . 0.0 110.626 177.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -72.65 -32.56 65.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.009 175.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.656 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -66.09 -52.2 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.778 178.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' TYR . . . . . 0.798 ' HA ' HD12 ' B' ' 34' ' ' LEU . 59.8 t80 -63.66 -29.87 71.05 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 122.221 -0.299 . . . . 0.0 111.063 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -52.75 63.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.056 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.651 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.2 OUTLIER -68.95 -26.51 65.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.259 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' B' ' 31' ' ' TYR . 46.8 mt -70.62 -49.69 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.023 0.439 . . . . 0.0 111.261 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -76.28 -24.65 54.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.233 -173.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.65 -34.19 15.53 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.129 -178.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.53 ' HB2' HG13 ' B' ' 40' ' ' ILE . 0.5 OUTLIER -126.64 102.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.563 -177.46 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -70.23 8.29 0.91 Allowed 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 123.327 2.685 . . . . 0.0 113.947 -176.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -92.33 -27.41 17.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.283 0.563 . . . . 0.0 109.588 173.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.913 HG12 ' HG2' ' B' ' 84' ' ' PRO . 2.8 mt -82.53 99.41 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.841 175.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.631 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -90.28 145.17 25.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.362 -176.096 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.928 HD11 ' HB2' ' B' ' 88' ' ' PHE . 2.5 tp -102.89 130.3 49.89 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.564 HG12 ' HE2' ' B' ' 65' ' ' MET . 94.4 mt -109.01 118.7 57.12 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.807 178.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.825 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -97.13 122.48 40.18 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.633 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.56 98.41 6.43 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 115.045 -0.98 . . . . 0.0 108.632 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . 0.634 ' HG3' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -161.41 169.89 21.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.993 -174.123 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.96 142.44 76.31 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 177.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -78.81 -19.23 11.22 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.683 2.255 . . . . 0.0 114.028 -174.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.41 -48.88 25.04 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 122.097 -0.377 . . . . 0.0 111.391 -176.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' GLU . . . . . 0.454 ' HG3' ' HB2' ' A' ' 49' ' ' ASP . 0.9 OUTLIER -67.74 -29.33 68.53 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 174.561 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -44.5 97.11 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.051 174.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -59.39 -38.68 81.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.98 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.61 -47.98 10.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.823 -171.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.71 -34.68 11.85 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -170.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.87 163.64 11.31 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.655 178.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.04 152.58 70.32 Favored Pre-proline 0 C--N 1.327 -0.4 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -58.39 122.79 12.27 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.521 2.147 . . . . 0.0 112.893 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -98.61 79.72 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.339 0.59 . . . . 0.0 110.272 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.631 HG22 ' HB2' ' B' ' 62' ' ' TYR . 1.2 m -113.43 162.78 11.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 178.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -41.33 88.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.315 -174.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.434 ' HB2' HG23 ' B' ' 41' ' ' THR . 19.9 p30 -121.26 67.84 0.88 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.522 0.677 . . . . 0.0 111.208 -177.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' TYR . . . . . 0.825 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -105.52 125.32 50.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.808 176.736 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.631 ' HE2' HG21 ' B' ' 41' ' ' THR . 3.7 mtmt -123.01 120.88 34.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.004 0.431 . . . . 0.0 110.617 176.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' HIS . . . . . 0.464 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 12.9 t-160 -87.22 113.69 23.18 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' MET . . . . . 0.923 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.636 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.795 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.653 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -44.79 -59.49 4.05 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -174.836 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.653 ' HD3' ' CD ' ' B' ' 71' ' ' GLU . 11.9 Cg_exo -73.93 -17.38 22.52 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.453 2.102 . . . . 0.0 113.392 -176.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.923 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -91.11 -21.88 20.98 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.73 0.3 . . . . 0.0 110.636 -177.502 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.672 HD21 HD21 ' B' ' 102' ' ' LEU . 10.6 tp -62.34 -29.02 70.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.452 0.644 . . . . 0.0 110.885 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.713 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -77.22 -30.24 54.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.782 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.45 -7.18 32.19 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -171.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -27.02 57.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.807 0.337 . . . . 0.0 111.483 -176.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.15 51.23 2.45 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.306 -174.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 49.7 mt -109.46 142.79 39.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.914 0.387 . . . . 0.0 110.201 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.457 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 16.9 t70 -136.1 138.93 28.7 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.377 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 48.7 Cg_exo -60.95 16.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.631 2.887 . . . . 0.0 114.549 -175.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.453 ' HG2' ' OD2' ' B' ' 80' ' ' ASP . 0.2 OUTLIER -107.68 -6.38 16.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 174.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 28.6 mttm -103.86 143.85 27.49 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.986 -175.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.913 ' HG2' HG12 ' B' ' 40' ' ' ILE . 8.4 Cg_endo -83.12 141.01 10.19 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 C-N-CA 122.98 2.453 . . . . 0.0 111.108 174.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.0 OUTLIER -140.45 146.79 23.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.43 -178.324 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.509 ' CG1' HD21 ' B' ' 34' ' ' LEU . 2.2 p -124.79 140.3 48.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . 0.877 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 4.2 m -107.23 125.51 63.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.656 -177.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' PHE . . . . . 0.928 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.7 t80 -99.85 150.24 22.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.354 -178.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . 0.634 ' SG ' ' HG3' ' B' ' 46' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.392 0 CA-C-O 121.459 0.647 . . . . 0.0 111.701 -179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . 0.877 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.527 0.081 0 CA-C-O 120.819 0.343 . . . . 0.0 111.141 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.34 -32.69 66.98 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.145 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -71.35 -27.9 63.69 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.079 0.466 . . . . 0.0 110.81 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 98' ' ' ALA . . . . . 0.415 ' HB1' HD22 ' B' ' 70' ' ' LEU . . . -73.47 -44.58 57.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.931 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -87.05 -40.93 6.84 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.782 -174.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 100' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -66.6 -29.54 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.004 0.402 . . . . 0.0 111.295 -174.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . 0.473 ' HA ' ' HG3' ' B' ' 104' ' ' GLU . 8.0 m -72.74 -35.66 67.57 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.939 0.4 . . . . 0.0 111.127 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 102' ' ' LEU . . . . . 0.672 HD21 HD21 ' B' ' 74' ' ' LEU . 11.2 mt -66.61 -37.01 83.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 103' ' ' ARG . . . . . 0.574 ' HD3' ' O ' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -67.03 -25.07 66.09 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 179.194 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.473 ' HG3' ' HA ' ' B' ' 101' ' ' THR . 2.5 mt-10 -68.73 -6.6 27.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.23 174.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . 0.489 ' CE1' ' HB ' ' A' ' 10' ' ' THR . 17.2 m-85 -110.18 -11.2 14.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.68 0.276 . . . . 0.0 110.744 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 97.75 60.47 0.93 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.349 -0.929 . . . . 0.0 113.2 174.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 107' ' ' PHE . . . . . 0.532 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.1 m-85 -92.46 158.16 16.18 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.745 -0.268 . . . . 0.0 110.291 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -61.26 -70.27 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.535 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.6 113.97 9.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 178.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 110' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.3 tt -113.06 123.5 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.625 0.726 . . . . 0.0 110.936 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 111' ' ' TYR . . . . . 0.415 ' O ' ' HA ' ' B' ' 86' ' ' VAL . 1.3 m-85 -113.99 146.81 39.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.271 -176.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -111.33 138.67 47.52 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.496 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 8.4 m -87.57 111.84 21.64 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.982 0.42 . . . . 0.0 112.038 -174.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.408 ' HG2' ' SD ' ' B' ' 24' ' ' MET . 0.8 OUTLIER -63.21 148.28 48.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.253 177.081 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 85.38 -109.23 3.29 Favored Glycine 0 N--CA 1.442 -0.95 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.175 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 162.57 -157.77 29.79 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 178.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 3.0 tmm? -60.6 -33.89 73.41 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.122 0.486 . . . . 0.0 110.144 177.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.585 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.52 -34.5 74.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.854 179.294 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 119' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -72.74 -32.38 65.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.535 0.207 . . . . 0.0 111.384 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 120' ' ' TRP . . . . . 0.759 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 20.2 t-105 -64.39 -54.63 29.78 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.84 -43.41 98.86 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.499 0.19 . . . . 0.0 111.163 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.585 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.6 OUTLIER -63.09 -33.08 74.69 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.898 -176.252 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . 0.599 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -82.96 -3.91 57.67 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.992 -177.28 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.18 27.75 73.6 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.672 -178.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.599 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 70.1 mt -72.47 161.97 76.36 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.273 . . . . 0.0 110.283 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.597 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 21.8 Cg_endo -57.21 108.68 0.38 Allowed 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.851 2.367 . . . . 0.0 111.642 178.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.63 149.99 51.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 2.7 mt . . . . . 0 C--N 1.318 -0.767 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.694 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.1 mmt . . . . . 0 C--O 1.232 0.183 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.659 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -52.16 -26.57 20.92 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 114.39 -1.277 . . . . 0.0 113.214 -179.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -33.27 57.62 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.542 ' HG3' ' N ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -61.29 -46.57 89.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.395 . . . . 0.0 112.001 -174.845 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.659 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 1.8 p90 -91.52 -20.51 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.821 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.51 -50.57 65.13 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 110.911 -177.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.71 -32.11 73.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.513 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -42.68 72.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.495 178.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.608 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.1 OUTLIER -56.82 -38.27 72.36 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.144 0.497 . . . . 0.0 110.152 176.435 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -32.17 73.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.652 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.32 -45.33 32.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.763 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -68.86 -51.45 40.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.657 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 22.3 t -61.97 -34.13 61.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.945 -176.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -58.7 -35.24 72.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.552 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -28.99 69.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 111.217 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.7 -31.75 61.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.622 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.54 ' HG3' ' SD ' ' A' ' 24' ' ' MET . 0.6 OUTLIER -76.9 -24.02 52.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.664 0.745 . . . . 0.0 110.119 173.74 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.9 -17.4 53.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.676 -178.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.602 ' HB3' ' HB2' ' A' ' 100' ' ' LYS . 0.4 OUTLIER -86.58 19.04 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -175.634 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.443 ' SD ' ' HA ' ' A' ' 96' ' ' ALA . 0.1 OUTLIER -149.35 157.68 43.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.537 178.197 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -75.7 103.05 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.179 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.574 ' SD ' ' HG2' ' A' ' 114' ' ' GLU . 1.4 mmt -72.07 125.9 28.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.693 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -141.65 152.58 44.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.322 -178.033 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 139.8 37.13 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.774 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -50.46 -19.38 4.72 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.578 2.852 . . . . 0.0 113.982 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -46.01 51.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.848 0.356 . . . . 0.0 111.066 176.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.49 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 1.2 t70 -77.39 -29.32 53.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.971 0.415 . . . . 0.0 110.458 178.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.94 -36.25 77.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.43 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -74.38 -39.76 62.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.777 -177.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 29' ' ' ASP . 2.4 pttt -63.08 -41.08 99.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.98 -0.288 . . . . 0.0 111.592 -174.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.536 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -74.19 -26.19 60.13 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.764 0.316 . . . . 0.0 110.612 176.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.698 HD11 ' HB2' ' A' ' 42' ' ' LEU . 4.6 mt -61.16 -54.43 44.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.408 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -75.8 -28.32 58.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.547 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.528 ' HG2' ' HA ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -84.6 -22.65 29.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.825 0.345 . . . . 0.0 111.158 -176.166 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -121.05 106.83 38.37 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.209 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.541 ' HA ' HD21 ' A' ' 61' ' ' ASN . 14.0 Cg_exo -67.69 -0.94 5.89 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.817 2.345 . . . . 0.0 112.288 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.49 -25.33 15.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.066 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.624 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 53.6 mt -84.84 111.5 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.067 176.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.728 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -106.71 144.91 32.68 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.967 -176.647 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 1.0 HD11 ' HB2' ' A' ' 88' ' ' PHE . 25.8 tp -101.94 125.97 48.74 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.464 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 4.1 mt -108.96 106.24 20.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.176 174.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.784 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 3.6 t0 -83.2 125.18 31.28 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.674 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -110.31 97.19 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.603 0.716 . . . . 0.0 109.122 -178.731 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.55 ' HD2' ' SD ' ' A' ' 117' ' ' MET . 0.0 OUTLIER -162.51 -164.27 1.0 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.405 -176.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.484 ' CG ' HH12 ' B' ' 46' ' ' ARG . 11.7 m-20 -119.92 143.87 36.18 Favored Pre-proline 0 C--N 1.325 -0.472 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -177.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -65.68 -24.34 55.3 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 123.064 2.509 . . . . 0.0 114.194 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.82 -48.06 34.09 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.359 -176.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -27.35 64.56 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.137 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.28 -43.3 99.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.943 173.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -59.97 -35.95 76.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.578 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.15 -37.31 23.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.336 -175.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.3 mmm -100.47 -34.4 9.95 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -173.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 119.19 169.01 14.2 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 121.138 -0.553 . . . . 0.0 112.059 -178.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.475 ' HG3' ' HB2' ' A' ' 128' ' ' LEU . 6.2 pttt -138.3 158.07 71.44 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HB3' ' CZ2' ' A' ' 120' ' ' TRP . 19.8 Cg_exo -68.2 133.87 29.86 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.315 2.01 . . . . 0.0 113.137 -176.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.638 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 21.3 t0 -97.13 86.42 3.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 176.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.584 HG22 ' HB2' ' A' ' 62' ' ' TYR . 6.5 m -133.28 159.66 42.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.307 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.928 -175.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.541 HD21 ' HA ' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -116.99 84.34 2.13 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.902 0.382 . . . . 0.0 110.737 -177.302 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.784 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 5.8 t80 -125.51 126.94 45.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.401 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.728 ' HE2' HG21 ' A' ' 41' ' ' THR . 8.5 mttm -127.34 126.88 43.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.231 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -96.59 120.96 37.86 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.503 0.192 . . . . 0.0 110.668 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.738 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.365 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 177.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.738 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 112.483 0.549 . . . . 0.0 112.483 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.702 ' HG3' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -53.51 -42.76 93.58 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.455 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.702 ' HD3' ' HG3' ' A' ' 71' ' ' GLU . 9.7 Cg_exo -71.95 -18.06 28.13 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.573 1.516 . . . . 0.0 111.856 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -97.6 -21.81 16.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.81 -176.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.677 HD21 HD21 ' A' ' 102' ' ' LEU . 15.3 tp -55.14 -56.63 17.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.971 -177.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.33 -19.91 64.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.039 -175.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -85.2 -12.26 53.07 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.51 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 20.3 m -105.42 35.9 2.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -173.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.04 56.98 5.0 Favored Glycine 0 C--N 1.335 0.474 0 O-C-N 123.365 0.415 . . . . 0.0 113.526 174.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.522 ' HA ' HD23 ' A' ' 79' ' ' LEU . 4.6 mt -109.19 140.98 42.09 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.769 0.319 . . . . 0.0 110.79 -178.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.55 154.64 76.89 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -68.74 2.67 2.79 Favored 'Trans proline' 0 CA--C 1.529 0.231 0 C-N-CA 122.802 2.335 . . . . 0.0 113.752 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.9 26.09 10.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.368 0.604 . . . . 0.0 110.176 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.8 mmtm -107.26 115.94 58.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -178.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.624 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 5.8 Cg_exo -74.06 103.75 1.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.574 2.182 . . . . 0.0 109.951 173.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.546 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 15.6 m -123.16 154.91 28.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.468 0.652 . . . . 0.0 111.79 -171.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.447 ' O ' HD12 ' A' ' 42' ' ' LEU . 1.4 p -122.68 145.48 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.766 174.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 43' ' ' ILE . 5.2 m -110.1 129.78 64.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 1.0 ' HB2' HD11 ' A' ' 42' ' ' LEU . 5.2 t80 -104.87 133.66 49.3 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.176 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' CYS . . . . . 0.481 ' HB3' ' HB2' ' A' ' 95' ' ' ALA . 35.5 t . . . . . 0 C--O 1.234 0.283 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 -177.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.674 ' HA ' HG21 ' A' ' 45' ' ' VAL . . . . . . . . 0 N--CA 1.468 0.473 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.443 ' HA ' ' SD ' ' A' ' 22' ' ' MET . . . -57.1 -36.94 71.23 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.73 -35.33 77.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.525 0.202 . . . . 0.0 111.175 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.474 ' HB2' HD22 ' A' ' 70' ' ' LEU . . . -75.01 -53.44 8.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.124 0.488 . . . . 0.0 110.926 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.44 -53.97 25.77 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.719 -175.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -62.88 -37.33 86.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.682 0.277 . . . . 0.0 111.176 -173.192 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.529 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 11.0 m -72.43 -39.52 67.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.677 HD21 HD21 ' A' ' 74' ' ' LEU . 11.7 mt -64.83 -47.7 77.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.689 0.28 . . . . 0.0 111.422 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.813 ' HA ' ' HB2' ' A' ' 107' ' ' PHE . 1.7 ptm180 -63.6 -27.08 68.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.102 0.477 . . . . 0.0 110.734 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.73 -5.42 25.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.232 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -110.68 -6.64 14.78 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.197 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.56 31.62 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.919 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.813 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 2.3 m-85 -81.56 142.5 32.77 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.436 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.1 tttt -62.88 -87.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.445 -176.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.436 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -116.45 120.88 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.371 -177.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.546 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 0.5 OUTLIER -125.52 129.42 72.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -178.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -118.6 154.55 32.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.327 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -131.27 158.49 40.47 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -82.09 139.14 34.59 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.113 0.482 . . . . 0.0 111.478 -176.31 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.574 ' HG2' ' SD ' ' A' ' 24' ' ' MET . 0.0 OUTLIER -99.68 18.81 17.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 176.595 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.76 -75.73 0.16 Allowed Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.928 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 150.34 174.86 21.88 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.014 -0.613 . . . . 0.0 111.96 179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' MET . . . . . 0.55 ' SD ' ' HD2' ' A' ' 46' ' ' ARG . 19.7 ttm -64.9 -36.37 84.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.419 0.628 . . . . 0.0 109.753 176.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -64.38 -27.78 69.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.044 177.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -69.37 -32.44 71.48 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 116.791 -0.186 . . . . 0.0 111.107 -179.165 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.675 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 27.8 t-105 -56.2 -52.29 64.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.417 ' HA ' HD23 ' A' ' 121' ' ' LEU . 3.3 mt -66.03 -40.86 91.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.444 178.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -68.13 -43.07 79.17 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.725 -175.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 119' ' ' LYS . 65.1 mt-10 -69.69 -18.12 63.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.763 0.316 . . . . 0.0 110.816 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 93.65 25.04 19.21 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.488 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.2 mt -80.45 152.46 73.05 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.638 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 13.8 Cg_endo -56.32 120.89 9.06 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 123.154 2.569 . . . . 0.0 112.286 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.63 157.29 45.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.469 -177.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.475 ' HB2' ' HG3' ' A' ' 56' ' ' LYS . 2.9 mt -110.62 101.66 10.3 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.09 178.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.322 -0.626 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.25 0 CA-C-O 120.758 0.313 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' GLY . . . . . 0.67 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -56.46 -27.07 53.25 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.469 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -74.61 -33.92 62.72 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.892 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.498 ' HG3' ' N ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -64.59 -47.05 80.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.872 -174.793 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.67 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 11.8 p90 -84.44 -24.26 29.6 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.38 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.85 -48.37 70.04 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.788 -178.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.23 -43.61 98.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.407 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -43.09 99.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.736 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' PHE . . . . . 0.566 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 2.1 t80 -56.48 -41.24 76.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.292 0.568 . . . . 0.0 110.339 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' LYS . . . . . 0.653 ' HD2' ' HB2' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.87 -26.97 67.88 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.756 179.361 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.81 -40.57 61.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.075 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -71.28 -50.43 32.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.317 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -33.45 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.146 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -66.79 -40.19 88.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.794 0.33 . . . . 0.0 111.268 178.026 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.54 -26.32 68.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.447 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.8 71.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.6 -178.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -21.35 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.03 0.443 . . . . 0.0 111.092 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.0 -19.65 62.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.33 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.403 ' OD1' ' HD3' ' B' ' 103' ' ' ARG . 2.6 t70 -78.42 -9.26 59.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.953 0.406 . . . . 0.0 111.345 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' MET . . . . . 0.588 ' HE1' ' HA3' ' B' ' 99' ' ' GLY . 11.8 mtp -116.93 165.7 13.03 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 122.212 -0.305 . . . . 0.0 110.998 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.53 111.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 174.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' MET . . . . . 0.685 ' HB3' ' HG3' ' B' ' 114' ' ' GLU . 0.7 OUTLIER -78.67 105.43 9.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.869 -175.109 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' B' ' 25' ' ' LEU . 0.5 OUTLIER -121.78 148.26 44.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.505 0.669 . . . . 0.0 111.333 -177.039 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.99 137.05 33.37 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.207 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -41.09 -31.65 0.86 Allowed 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 124.632 3.555 . . . . 0.0 115.388 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.647 ' HG3' ' OE1' ' B' ' 123' ' ' GLU . 13.5 mtmm -73.43 -40.86 63.9 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.41 0.55 . . . . 0.0 110.738 178.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -69.66 -34.91 74.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.151 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.1 -43.27 78.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.362 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' TYR . . . . . 0.437 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 73.2 t80 -67.07 -31.09 71.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.327 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 tptt -61.58 -52.73 63.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.825 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.533 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -72.26 -26.62 62.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 179.755 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.664 HD11 ' HB2' ' B' ' 42' ' ' LEU . 5.1 mt -59.55 -55.39 35.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.0 mm100 -74.1 -32.88 63.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.174 -175.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.98 -40.67 68.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.259 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -108.5 113.61 59.93 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.371 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.45 -3.61 12.16 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 0.0 112.913 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -103.89 -16.64 15.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.538 -178.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.533 HD12 ' HB2' ' B' ' 33' ' ' LEU . 16.3 mt -81.12 109.02 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-O 121.25 0.548 . . . . 0.0 109.927 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.673 HG21 ' HE2' ' B' ' 63' ' ' LYS . 97.0 m -97.68 142.59 29.29 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.262 -176.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.867 HD11 ' HB2' ' B' ' 88' ' ' PHE . 11.3 tp -103.8 126.45 50.94 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 169.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.85 118.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.793 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -95.16 126.45 40.5 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.619 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -115.63 97.77 6.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.677 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . 0.484 HH12 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -168.48 179.92 4.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.558 -177.738 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -98.68 154.79 37.3 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.237 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.28 -19.19 38.74 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.736 2.291 . . . . 0.0 113.452 -176.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -45.43 23.77 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.484 -178.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -30.63 63.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.67 -46.53 88.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.751 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.57 -31.83 71.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -85.06 -37.24 20.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 5.5 mtm -98.93 -19.51 17.29 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -172.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 98.77 165.62 30.47 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.729 -175.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -143.58 145.01 29.71 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . 0.458 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 13.8 Cg_endo -61.57 135.55 57.6 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.846 2.364 . . . . 0.0 112.724 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -112.32 84.24 1.94 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.378 178.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.488 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.5 m -121.69 167.22 15.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.381 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 mttm -60.43 -47.9 84.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -174.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.72 71.06 0.76 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.143 0.496 . . . . 0.0 110.906 -177.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' TYR . . . . . 0.793 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -114.92 131.59 56.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 177.239 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.673 ' HE2' HG21 ' B' ' 41' ' ' THR . 1.0 OUTLIER -133.8 126.84 31.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.261 0.553 . . . . 0.0 110.313 179.018 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -82.16 122.16 27.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.79 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' MET . . . . . 0.808 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.223 -177.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.596 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.423 0 N-CA-C 113.365 0.876 . . . . 0.0 113.365 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.475 ' H ' ' HG3' ' B' ' 71' ' ' GLU . 0.0 OUTLIER -50.2 -46.55 83.03 Favored Pre-proline 0 N--CA 1.474 0.755 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.483 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.459 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 34.1 Cg_exo -61.24 -18.55 59.29 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.969 1.779 . . . . 0.0 112.454 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.808 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -105.68 -21.14 13.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 0.0 110.52 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.577 HD21 HD21 ' B' ' 102' ' ' LEU . 9.7 tp -64.36 -33.32 75.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.536 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.65 -24.29 45.27 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.81 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 35.1 mtpt -86.69 -2.53 58.6 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -175.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' SER . . . . . 0.594 ' HB3' ' HD2' ' B' ' 63' ' ' LYS . 20.1 m -116.55 35.59 4.5 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 38.44 56.25 1.97 Allowed Glycine 0 C--N 1.338 0.661 0 O-C-N 123.626 0.579 . . . . 0.0 114.151 173.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 73.6 mt -103.25 140.04 37.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 0.0 110.542 -178.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.651 ' HB2' ' HG3' ' B' ' 83' ' ' LYS . 11.0 m-20 -126.06 140.71 37.59 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' PRO . . . . . 0.534 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 38.6 Cg_endo -66.16 6.34 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.812 2.342 . . . . 0.0 113.162 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.491 ' H ' ' HG3' ' B' ' 82' ' ' GLU . 0.9 OUTLIER -105.87 -7.02 18.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.942 0.401 . . . . 0.0 110.727 176.55 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' LYS . . . . . 0.651 ' HG3' ' HB2' ' B' ' 80' ' ' ASP . 3.0 mttp -96.13 133.22 25.42 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.837 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.486 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.9 Cg_exo -72.56 123.04 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.645 2.23 . . . . 0.0 111.382 176.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 25.6 m -128.5 155.53 40.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.85 0.357 . . . . 0.0 110.717 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.529 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 1.4 p -129.99 144.04 39.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 12.0 m -105.83 129.31 59.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.895 0.378 . . . . 0.0 110.433 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' PHE . . . . . 0.867 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.3 t80 -105.84 130.04 53.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.666 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . 0.663 ' HB3' ' HB2' ' B' ' 95' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.393 0 O-C-N 125.194 1.559 . . . . 0.0 107.087 -177.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . 0.663 ' HB2' ' HB3' ' B' ' 89' ' ' CYS . . . . . . . . 0 N--CA 1.463 0.203 0 CA-C-O 120.762 0.315 . . . . 0.0 111.31 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.59 75.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.255 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -68.22 -30.79 69.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.028 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.68 -38.39 54.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.707 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 99' ' ' GLY . . . . . 0.588 ' HA3' ' HE1' ' B' ' 22' ' ' MET . . . -96.61 -41.85 3.52 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.939 -171.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -24.6 67.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.011 0.434 . . . . 0.0 110.867 -176.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.86 -53.94 11.66 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.574 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 102' ' ' LEU . . . . . 0.577 HD21 HD21 ' B' ' 74' ' ' LEU . 32.2 mt -55.28 -44.6 75.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.797 -175.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 103' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.0 OUTLIER -64.96 -31.17 72.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 110.811 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -75.52 -6.71 51.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.222 176.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . 0.608 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 16.5 m-30 -99.91 -11.36 20.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.953 0.406 . . . . 0.0 110.132 177.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.09 25.75 2.2 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.096 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 107' ' ' PHE . . . . . 0.595 ' HB2' ' HA ' ' B' ' 103' ' ' ARG . 2.3 m-85 -76.09 152.0 36.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 0.0 110.661 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -75.55 -77.7 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.335 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.39 109.31 13.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.005 0.431 . . . . 0.0 110.931 -178.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 110' ' ' ILE . . . . . 0.457 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.8 tt -114.57 129.68 70.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.587 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 111' ' ' TYR . . . . . 0.529 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 4.1 m-85 -113.37 143.72 44.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.056 -174.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.512 ' HB3' ' HE3' ' B' ' 24' ' ' MET . 19.5 t-20 -113.68 140.3 48.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 173.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.444 ' OG ' ' HD1' ' B' ' 88' ' ' PHE . 15.7 m -83.01 108.32 16.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.816 0.341 . . . . 0.0 111.634 -176.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.685 ' HG3' ' HB3' ' B' ' 24' ' ' MET . 0.5 OUTLIER -71.99 30.16 0.05 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.645 -176.012 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . 0.555 ' HA3' ' HG2' ' B' ' 119' ' ' LYS . . . -145.1 -73.83 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.28 178.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 135.01 -177.63 19.17 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.675 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.89 -32.57 72.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.207 0.527 . . . . 0.0 110.812 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 30.0 p-10 -66.24 -28.85 69.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.936 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 119' ' ' LYS . . . . . 0.555 ' HG2' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -74.11 -33.21 63.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.301 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 120' ' ' TRP . . . . . 0.772 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 19.3 t-105 -58.93 -49.91 76.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.913 0.387 . . . . 0.0 110.314 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.1 mt -68.67 -36.86 79.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.972 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.7 OUTLIER -68.32 -44.53 75.19 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . 0.647 ' OE1' ' HG3' ' B' ' 28' ' ' LYS . 68.1 mt-10 -80.1 8.61 6.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -176.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.58 21.36 77.28 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.245 172.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.479 HD21 ' HG2' ' B' ' 28' ' ' LYS . 96.0 mt -79.75 158.92 72.52 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-O 120.708 0.289 . . . . 0.0 111.001 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.438 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 41.5 Cg_endo -65.51 107.8 1.09 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.878 2.385 . . . . 0.0 112.326 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.84 150.39 46.46 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.321 -0.634 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.434 ' HB2' ' HD2' ' B' ' 81' ' ' PRO . 1.4 mpp? . . . . . 0 N--CA 1.455 -0.203 0 CA-C-O 120.823 0.345 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.774 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -59.65 -39.41 95.13 Favored Glycine 0 C--O 1.226 -0.395 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.748 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -39.47 91.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.045 0.45 . . . . 0.0 110.532 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.4 -55.78 29.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.106 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.918 ' HE2' ' HD3' ' B' ' 81' ' ' PRO . 3.0 p90 -78.97 -22.84 45.04 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.71 -176.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.575 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 18.6 t70 -54.31 -45.54 72.62 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.476 0.485 . . . . 0.0 110.613 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.05 91.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.945 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.94 -41.72 96.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.069 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.494 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.9 OUTLIER -58.76 -45.73 89.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.072 178.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -66.04 -27.85 68.41 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.694 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.46 -39.78 62.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -72.66 -49.06 34.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.693 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.817 HG11 ' HG2' ' B' ' 71' ' ' GLU . 1.4 t -64.14 -34.08 66.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.605 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -67.3 -30.85 70.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.588 0.232 . . . . 0.0 111.085 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.84 -25.56 67.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.006 0.432 . . . . 0.0 110.904 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.6 -29.89 63.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.103 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.35 -23.35 50.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.196 0.522 . . . . 0.0 110.836 174.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.82 -19.9 36.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.976 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.19 -21.9 66.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.155 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.607 ' HG3' ' HB2' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -138.24 -174.88 3.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.996 0.427 . . . . 0.0 111.621 -177.527 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.7 t -87.22 112.95 23.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.08 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.48 114.1 19.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.44 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -121.61 143.08 49.52 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 -177.25 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -73.97 140.14 77.07 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.893 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.407 ' HB3' ' HE3' ' A' ' 120' ' ' TRP . 2.0 Cg_endo -43.28 -36.27 6.11 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 124.232 3.288 . . . . 0.0 114.773 -175.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -41.26 61.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.927 0.394 . . . . 0.0 111.216 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -30.1 70.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.253 177.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.449 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.47 -45.69 52.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.604 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.737 ' HA ' HD12 ' A' ' 34' ' ' LEU . 60.4 t80 -63.38 -31.87 73.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.822 0.344 . . . . 0.0 111.097 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -56.87 -52.97 63.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.306 -178.649 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -70.4 -26.51 63.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.029 178.56 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.737 HD12 ' HA ' ' A' ' 31' ' ' TYR . 75.1 mt -64.34 -46.64 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.029 0.442 . . . . 0.0 111.008 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.726 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 1.2 pp0? -75.98 -29.51 58.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.572 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.63 -25.38 23.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -177.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -122.53 97.42 44.7 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.74 0.48 4.2 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.021 2.481 . . . . 0.0 112.818 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -95.43 -23.59 17.07 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 51.1 mt -80.07 112.38 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.172 173.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.732 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.2 OUTLIER -105.56 145.71 30.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.356 -174.192 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.984 HD11 ' HB2' ' A' ' 88' ' ' PHE . 4.3 tp -102.3 128.24 48.94 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -108.55 117.09 53.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 175.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.842 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.9 OUTLIER -105.4 138.13 42.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.224 -175.226 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.67 98.59 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.074 175.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.672 ' HD3' ' HG3' ' A' ' 117' ' ' MET . 0.2 OUTLIER -144.62 147.63 33.34 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.331 -176.881 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 1.362 ' CG ' HH11 ' B' ' 46' ' ' ARG . 70.5 m-20 -62.21 136.11 95.34 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 123.392 0.432 . . . . 0.0 111.086 -177.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -61.6 -31.38 86.94 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.07 2.514 . . . . 0.0 113.1 -177.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -78.37 -36.6 45.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.761 ' HB2' ' CG ' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -67.94 -34.53 76.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.36 175.355 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.615 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 tp -57.9 -34.59 69.98 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.418 0.628 . . . . 0.0 110.315 176.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -75.74 -39.1 57.77 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.763 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.88 -48.25 11.77 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 mtm -97.54 -36.61 10.25 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.595 -174.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.28 172.79 13.53 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.248 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.615 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -136.11 152.06 74.73 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -61.42 126.04 18.28 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.088 1.859 . . . . 0.0 112.769 -177.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.614 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 63.5 t0 -87.71 87.93 7.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.283 175.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.96 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -123.27 144.91 31.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.79 179.354 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.726 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.69 -42.14 71.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.036 -176.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.732 ' HB2' HG23 ' A' ' 41' ' ' THR . 7.3 p30 -114.47 72.97 0.8 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.25 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.96 ' HB2' HG23 ' A' ' 59' ' ' VAL . 7.5 t80 -97.47 117.91 32.78 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.474 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.62 ' HE2' HG21 ' A' ' 41' ' ' THR . 6.4 mtmm -117.97 110.83 18.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.962 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -83.5 116.3 22.48 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.937 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.54 0 CA-C-O 120.997 0.427 . . . . 0.0 110.989 -174.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.937 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.473 0.695 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.586 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -45.38 -56.52 9.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.632 ' O ' ' HG3' ' A' ' 76' ' ' LYS . 11.5 Cg_exo -72.92 -18.32 24.53 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.898 1.732 . . . . 0.0 113.026 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.731 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 1.0 OUTLIER -90.44 -16.42 29.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.042 0.449 . . . . 0.0 110.384 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.645 HD13 HD11 ' A' ' 70' ' ' LEU . 42.1 tp -68.11 -35.87 78.84 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.134 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.42 -31.21 53.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.329 175.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.632 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 3.0 mttm -70.08 -25.09 63.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.912 -176.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.92 -44.74 13.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.946 0.403 . . . . 0.0 110.634 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.52 58.0 0.97 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.776 -0.726 . . . . 0.0 111.598 -176.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.609 ' HB3' ' HZ ' ' A' ' 107' ' ' PHE . 7.4 mt -91.6 145.02 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.604 0.24 . . . . 0.0 110.467 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -122.15 140.15 31.85 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -67.37 5.56 0.89 Allowed 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.881 2.388 . . . . 0.0 114.371 -173.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -101.85 -11.41 19.06 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.779 -0.575 . . . . 0.0 110.437 175.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.8 mptp? -87.9 119.96 70.66 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.257 -179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.675 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 12.5 Cg_exo -67.68 133.46 29.74 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.683 2.255 . . . . 0.0 111.086 176.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 3.8 m -136.19 155.57 35.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.047 0.451 . . . . 0.0 111.213 -177.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 p -124.68 141.86 43.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.269 176.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.822 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 3.6 m -107.95 143.34 18.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.984 ' HB2' HD11 ' A' ' 42' ' ' LEU . 5.7 t80 -123.21 139.2 54.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -174.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 124.416 1.086 . . . . 0.0 111.974 -179.929 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.822 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.531 0.213 0 CA-C-O 120.889 0.376 . . . . 0.0 111.335 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.41 -34.64 72.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.21 -32.31 70.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.14 -38.14 61.13 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.644 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.41 -44.8 3.64 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.704 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -61.5 -24.85 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.8 0.333 . . . . 0.0 110.854 -174.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.0 -50.75 26.1 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-O 121.359 0.599 . . . . 0.0 110.713 175.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.429 ' HA ' HD23 ' A' ' 102' ' ' LEU . 14.5 mt -55.05 -39.51 69.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.95 -173.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.49 -27.65 67.96 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.849 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 3.8 mt-10 -76.41 -7.78 55.76 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.024 0.44 . . . . 0.0 110.704 175.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.513 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 13.8 m-85 -103.65 -2.9 25.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.144 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 125.97 -12.15 7.28 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.232 -0.985 . . . . 0.0 113.685 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.609 ' HZ ' ' HB3' ' A' ' 79' ' ' LEU . 23.8 m-85 -59.44 111.8 1.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.082 0.467 . . . . 0.0 110.785 -177.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -66.97 -50.86 60.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.366 -171.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.675 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 1.8 m -121.54 101.99 7.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.195 0.522 . . . . 0.0 111.312 -174.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.3 tt -121.15 130.9 74.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.922 -176.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -112.77 141.76 46.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.591 -176.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.607 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 19.6 t-20 -113.09 144.21 43.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.576 ' OG ' ' HA ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -79.86 130.42 35.3 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -171.055 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -174.71 1.55 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.196 171.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.883 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 45.76 -104.14 0.06 OUTLIER Glycine 0 CA--C 1.518 0.249 0 O-C-N 123.413 0.445 . . . . 0.0 113.576 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -177.46 -163.11 28.84 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 177.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' MET . . . . . 0.672 ' HG3' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -71.93 -29.39 64.24 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.142 0.496 . . . . 0.0 109.978 176.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -33.56 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.87 178.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.924 ' HA ' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -66.95 -32.05 73.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.612 -179.006 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.689 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -61.54 -54.66 40.25 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 16.6 mt -63.55 -42.83 98.36 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.92 0.391 . . . . 0.0 111.207 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.924 ' HG2' ' HA ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -70.45 -32.86 70.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.492 ' N ' ' HG3' ' A' ' 122' ' ' GLU . 19.0 mm-40 -80.65 3.4 22.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.41 25.05 76.13 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.214 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.459 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 60.5 mt -74.24 161.7 77.12 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.614 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 35.3 Cg_endo -61.03 115.32 2.63 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.516 2.144 . . . . 0.0 111.385 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.24 150.39 51.94 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.513 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 5.7 mt -102.92 102.3 12.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.059 0.457 . . . . 0.0 110.154 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.319 -0.731 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' B' ' 6' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' GLY . . . . . 0.75 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.24 -44.57 96.37 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.689 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.98 -32.34 72.68 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.165 0.507 . . . . 0.0 110.888 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.576 ' HB2' ' HG3' ' B' ' 3' ' ' MET . 0.4 OUTLIER -71.55 -52.52 17.73 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.438 -174.491 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.75 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -83.81 -22.85 31.67 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.219 -176.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -53.24 -45.72 68.87 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.154 0.502 . . . . 0.0 109.989 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.26 -39.42 90.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.527 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.63 -46.74 62.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.451 0.167 . . . . 0.0 111.269 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' PHE . . . . . 0.513 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 0.4 OUTLIER -56.67 -43.17 80.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.411 0.624 . . . . 0.0 109.947 179.227 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' LYS . . . . . 0.597 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.7 OUTLIER -66.2 -26.39 67.37 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.486 176.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.89 -49.35 20.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.892 0.377 . . . . 0.0 111.124 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -62.91 -50.97 68.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.129 179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.41 -32.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.596 -175.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.597 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 6.3 ttmm -66.03 -40.76 91.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.583 0.23 . . . . 0.0 110.913 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.66 -27.01 62.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.485 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.85 -32.54 63.71 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.753 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -24.95 41.2 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.462 0.648 . . . . 0.0 110.702 172.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.04 -17.11 36.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.026 -0.988 . . . . 0.0 112.317 -175.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.585 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 8.4 t0 -69.05 -25.96 64.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.901 -174.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' MET . . . . . 0.63 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 5.8 ptm -119.73 176.68 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.847 0.356 . . . . 0.0 111.772 -176.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 41.2 t -74.17 111.97 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.916 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.1 109.36 15.59 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.854 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . 0.497 HD23 ' HA ' ' B' ' 25' ' ' LEU . 0.9 OUTLIER -119.52 146.04 45.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.317 0.58 . . . . 0.0 111.02 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.38 137.81 52.05 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.289 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 3.4 Cg_endo -48.24 -22.35 3.78 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 124.05 3.167 . . . . 0.0 114.419 -176.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 16.7 mtmm -73.26 -42.47 62.46 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.165 -0.334 . . . . 0.0 110.906 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.26 -32.89 49.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.147 0.498 . . . . 0.0 110.225 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' B' ' 27' ' ' PRO . . . -63.48 -47.89 79.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.268 177.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' TYR . . . . . 0.639 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 78.8 t80 -66.82 -33.39 75.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 177.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' B' ' 35' ' ' GLN . 9.0 tptp -56.92 -50.22 73.23 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.115 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.525 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -72.18 -26.3 62.01 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.727 177.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' B' ' 31' ' ' TYR . 18.4 mt -63.45 -51.04 67.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.858 0.361 . . . . 0.0 111.183 178.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -71.22 -31.25 67.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.395 -177.304 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -82.06 -38.29 25.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.822 0.344 . . . . 0.0 111.765 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -110.04 108.54 59.06 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.909 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.33 0.1 7.89 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.671 2.248 . . . . 0.0 111.759 176.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.22 -29.65 14.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.071 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.568 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 61.2 mt -82.63 109.43 16.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.948 177.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -102.23 143.57 31.85 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.798 -177.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.931 HD11 ' HB2' ' B' ' 88' ' ' PHE . 5.8 tp -100.19 127.9 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 174.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.416 HG12 ' CE ' ' B' ' 65' ' ' MET . 2.0 mt -109.13 118.3 56.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-O 121.235 0.54 . . . . 0.0 109.669 177.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.768 ' HB3' ' CE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -104.64 133.32 49.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.528 -0.76 . . . . 0.0 108.951 178.378 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.866 HG11 HD22 ' B' ' 70' ' ' LEU . 27.6 m -131.61 99.52 3.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.034 -0.985 . . . . 0.0 109.974 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . 1.362 HH11 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -153.93 165.27 36.64 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.614 -1.175 . . . . 0.0 109.36 -176.668 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 1.203 ' HB3' ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -66.51 129.86 94.13 Favored Pre-proline 0 C--N 1.316 -0.885 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.102 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' B' ' 52' ' ' LYS . 26.3 Cg_endo -68.72 -16.7 42.24 Favored 'Trans proline' 0 N--CA 1.474 0.349 0 C-N-CA 123.689 2.926 . . . . 0.0 114.843 -168.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.467 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . 0.4 OUTLIER -78.12 -46.62 20.19 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -173.531 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -71.2 -33.53 70.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 0.0 110.365 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.53 -44.39 97.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.338 175.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' B' ' 48' ' ' PRO . 1.7 ttpt -63.69 -37.08 86.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.747 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -97.46 -44.85 6.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -171.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 1.9 mmm -90.28 -34.8 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.405 -0.518 . . . . 0.0 112.33 -171.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' GLY . . . . . 0.491 ' HA2' ' O ' ' B' ' 128' ' ' LEU . . . 149.72 145.05 4.05 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.077 -1.059 . . . . 0.0 113.764 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' LYS . . . . . 0.439 ' HG3' ' HB2' ' B' ' 128' ' ' LEU . 0.0 OUTLIER -133.9 165.07 39.48 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 174.67 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.11 129.37 17.11 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.576 1.518 . . . . 0.0 112.559 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . 0.605 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 13.4 t70 -90.37 95.33 10.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.604 HG23 ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -138.27 153.14 26.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.598 -174.191 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -34.24 70.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.312 -176.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -132.53 79.39 1.85 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.31 0.576 . . . . 0.0 111.867 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' TYR . . . . . 0.768 ' CE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -139.08 137.62 36.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.482 176.287 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -120.7 129.09 53.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.944 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -90.29 111.74 23.04 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' MET . . . . . 0.553 ' HG2' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.519 0 CA-C-O 120.541 0.21 . . . . 0.0 110.516 -176.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.866 HD22 HG11 ' B' ' 45' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.482 1.126 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.817 ' HG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -45.41 -63.97 1.05 Allowed Pre-proline 0 CA--C 1.547 0.837 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -174.417 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.573 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 61.8 Cg_endo -75.24 -12.78 21.05 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.349 2.033 . . . . 0.0 113.561 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.553 ' HB3' ' HG2' ' B' ' 65' ' ' MET . 0.1 OUTLIER -89.5 2.73 54.18 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.318 -0.239 . . . . 0.0 111.169 -174.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.95 HD21 HD21 ' B' ' 102' ' ' LEU . 8.7 tp -72.74 -52.86 13.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.344 -177.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -72.13 -19.68 61.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.733 0.302 . . . . 0.0 111.498 -177.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.65 -27.57 31.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.648 -175.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -77.95 -27.12 49.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -177.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.24 75.38 1.3 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.511 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 9.5 mt -129.59 145.23 51.5 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -128.03 138.47 33.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' PRO . . . . . 0.918 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 35.6 Cg_endo -69.21 12.48 0.28 Allowed 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.209 2.606 . . . . 0.0 114.245 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -102.77 -12.11 17.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 176.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -95.5 133.91 25.09 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.279 -177.274 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.568 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.7 Cg_exo -71.65 126.8 12.42 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.429 2.086 . . . . 0.0 110.839 175.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 6.3 m -132.11 151.88 35.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.534 -176.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 1.6 p -125.62 141.78 44.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . 0.825 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 16.6 m -107.73 141.03 23.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' PHE . . . . . 0.931 ' HB2' HD11 ' B' ' 42' ' ' LEU . 8.9 t80 -119.12 141.48 48.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.034 -173.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . 0.589 ' HB2' ' O ' ' B' ' 88' ' ' PHE . 1.4 m . . . . . 0 N--CA 1.473 0.678 0 C-N-CA 123.618 0.767 . . . . 0.0 111.754 -179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . 0.825 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.458 -0.051 0 CA-C-O 121.047 0.451 . . . . 0.0 110.625 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.52 -33.58 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.69 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.07 -29.75 70.14 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.602 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 98' ' ' ALA . . . . . 0.425 ' HB2' HD21 ' B' ' 70' ' ' LEU . . . -75.88 -56.04 5.05 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.293 0.568 . . . . 0.0 110.685 176.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 99' ' ' GLY . . . . . 0.42 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -71.74 -48.63 27.32 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.023 -0.99 . . . . 0.0 114.464 -171.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 100' ' ' LYS . . . . . 0.585 ' HB2' ' HB3' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -68.41 -33.71 74.72 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.497 -0.413 . . . . 0.0 111.107 -174.154 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . 0.409 HG22 ' CE2' ' B' ' 105' ' ' TYR . 6.2 m -72.07 -36.01 69.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.656 0.265 . . . . 0.0 110.889 176.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 102' ' ' LEU . . . . . 0.95 HD21 HD21 ' B' ' 74' ' ' LEU . 8.9 mt -64.18 -47.75 78.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.446 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 103' ' ' ARG . . . . . 0.486 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.6 OUTLIER -65.1 -26.99 68.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.791 0.329 . . . . 0.0 110.597 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 2.9 mt-10 -73.11 -6.79 48.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.33 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . 0.409 ' CE2' HG22 ' B' ' 101' ' ' THR . 22.0 m-30 -106.07 -8.37 17.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.961 0.41 . . . . 0.0 110.284 175.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 109.28 60.92 0.52 Allowed Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.49 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 107' ' ' PHE . . . . . 0.66 ' CE1' HD22 ' B' ' 102' ' ' LEU . 1.3 m-85 -104.48 139.61 39.15 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 176.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 -77.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.498 0.499 . . . . 0.0 111.522 -175.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.503 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 2.7 m -129.94 109.05 10.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.141 0.495 . . . . 0.0 111.238 -178.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 110' ' ' ILE . . . . . 0.563 HG12 ' HE3' ' B' ' 22' ' ' MET . 2.3 tt -115.77 130.33 70.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.672 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -114.6 146.85 40.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.45 -177.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.63 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 7.0 t-20 -111.27 138.4 47.79 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 172.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.508 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 65.5 m -87.83 112.64 22.68 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -62.06 145.76 52.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.966 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.75 -110.6 3.32 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.434 -0.889 . . . . 0.0 111.624 -174.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 116' ' ' GLY . . . . . 0.492 ' H ' ' HB2' ' B' ' 119' ' ' LYS . . . 160.37 -162.5 33.35 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.88 -36.19 74.24 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.011 0.434 . . . . 0.0 110.699 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 3.5 t70 -61.85 -35.06 77.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.406 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 119' ' ' LYS . . . . . 0.539 ' O ' ' HG2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -74.01 -33.42 63.78 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.806 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 120' ' ' TRP . . . . . 0.925 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 25.9 t-105 -57.6 -52.96 63.28 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.59 -39.84 95.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.024 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -70.67 -35.15 72.7 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 112.341 0.496 . . . . 0.0 112.341 -174.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 19.1 mm-40 -74.83 -4.24 36.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.813 0.34 . . . . 0.0 110.519 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.07 23.85 73.23 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.705 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.49 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 72.4 mt -76.67 160.78 76.25 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.49 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 29.5 Cg_endo -61.39 108.26 0.58 Allowed 'Trans proline' 0 C--O 1.236 0.397 0 C-N-CA 122.35 2.033 . . . . 0.0 111.221 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.71 156.01 43.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.714 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 128' ' ' LEU . . . . . 0.605 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 8.4 mt . . . . . 0 C--N 1.318 -0.796 0 CA-C-O 120.897 0.38 . . . . 0.0 110.398 179.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.827 0.346 . . . . 0.0 111.304 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.651 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -49.98 -23.45 5.48 Favored Glycine 0 CA--C 1.522 0.493 0 CA-C-N 115.127 -0.942 . . . . 0.0 114.061 -174.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -73.78 -32.68 63.9 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -64.07 -47.38 80.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -173.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.651 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.3 p90 -91.1 -23.19 20.38 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.967 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.654 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 2.9 t70 -53.59 -54.92 30.69 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.852 0.358 . . . . 0.0 110.629 -178.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.96 -42.24 89.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.526 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . 0.518 ' HB ' ' CZ ' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -68.91 -44.98 72.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.41 -178.505 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.559 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.6 OUTLIER -57.93 -47.41 82.94 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.253 0.549 . . . . 0.0 110.074 -179.377 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.517 ' HD2' ' HD2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -64.76 -26.29 68.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.107 177.127 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.13 -40.78 64.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.883 0.373 . . . . 0.0 111.392 178.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -72.36 -49.88 30.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.793 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 t -62.07 -36.47 74.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.303 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HD2' ' HD2' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -64.14 -30.05 71.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.566 0.222 . . . . 0.0 111.49 179.558 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.02 68.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 110.687 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.439 ' HB1' ' HB1' ' A' ' 96' ' ' ALA . . . -73.62 -30.13 62.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.397 177.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -77.02 -24.15 52.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.528 0.68 . . . . 0.0 110.302 172.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.86 35.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.981 -1.008 . . . . 0.0 111.234 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -71.03 -24.21 62.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.787 -175.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.864 ' HE3' ' HA3' ' A' ' 99' ' ' GLY . 14.5 mtp -121.23 178.47 4.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.691 0.282 . . . . 0.0 111.158 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.7 112.45 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.541 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -78.28 103.19 8.06 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.174 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' A' ' 25' ' ' LEU . 3.2 mt -112.08 139.62 47.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.979 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.39 147.77 57.35 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.897 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.532 ' HB3' ' CE3' ' A' ' 120' ' ' TRP . 26.9 Cg_exo -34.18 -56.42 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.536 3.49 . . . . 0.0 114.394 -175.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.601 ' HG3' ' OE1' ' A' ' 123' ' ' GLU . 4.4 mttp -63.37 -37.82 88.76 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.51 -34.91 76.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 0.0 110.343 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.621 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -71.79 -47.37 53.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.518 176.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.597 ' HA ' HD12 ' A' ' 34' ' ' LEU . 82.6 t80 -60.02 -32.25 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.351 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.73 -51.87 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.438 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -74.31 -27.16 60.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.033 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 30' ' ' ALA . 81.6 mt -62.98 -55.35 26.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.989 0.423 . . . . 0.0 111.263 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.684 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -75.85 -22.27 56.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.071 -173.601 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.72 -24.29 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.883 0.373 . . . . 0.0 110.791 -177.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -129.49 94.11 33.54 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HA ' ' ND2' ' A' ' 61' ' ' ASN . 40.8 Cg_endo -68.81 9.58 0.44 Allowed 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.73 2.287 . . . . 0.0 113.103 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -91.12 -29.17 17.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.614 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 26.2 mt -83.16 100.91 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.458 173.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.66 HG21 ' HE2' ' A' ' 63' ' ' LYS . 9.9 m -92.61 146.8 23.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.401 -175.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.966 HD11 ' HB2' ' A' ' 88' ' ' PHE . 8.3 tp -100.74 128.3 46.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 173.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.418 HG23 ' SD ' ' A' ' 65' ' ' MET . 13.1 mt -109.59 118.15 56.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.442 177.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.852 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -102.39 124.02 47.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.225 0.536 . . . . 0.0 109.869 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -109.26 96.68 4.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.429 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.7 ' NE ' ' HA ' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -150.06 163.33 38.45 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.294 -176.32 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' A' ' 50' ' ' GLU . 6.0 t70 -75.91 137.28 69.6 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.786 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -59.6 -29.95 91.13 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.677 2.251 . . . . 0.0 112.367 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.23 -36.23 47.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.809 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.58 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -65.88 -35.79 81.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 173.251 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.865 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.0 OUTLIER -65.51 -33.67 76.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.734 177.232 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -42.08 61.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.648 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.06 -45.55 23.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -175.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.1 mtp -101.41 -34.7 9.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 116.41 179.14 18.05 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.56 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.865 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -148.23 155.7 43.09 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.108 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.475 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 23.4 Cg_endo -65.52 137.51 50.91 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.413 2.076 . . . . 0.0 112.598 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.69 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t0 -111.95 84.72 2.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.229 0.537 . . . . 0.0 110.595 178.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.776 HG22 ' HB2' ' A' ' 62' ' ' TYR . 13.0 m -112.02 163.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.005 176.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.684 ' HD2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.83 -42.94 72.53 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.634 0.584 . . . . 0.0 111.59 -177.546 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.409 ' ND2' ' HA ' ' A' ' 38' ' ' PRO . 27.6 p-10 -120.47 76.76 1.21 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.724 0.773 . . . . 0.0 111.206 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.852 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 2.4 t80 -116.99 125.97 52.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.431 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.66 ' HE2' HG21 ' A' ' 41' ' ' THR . 6.3 mttm -122.02 123.53 41.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.124 176.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.428 ' HB2' ' OH ' ' A' ' 62' ' ' TYR . 11.4 t-160 -94.64 132.93 38.85 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.628 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.662 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.66 178.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.628 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.512 -0.489 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.833 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.8 mp0 -49.05 -60.1 5.28 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.708 -177.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.833 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 13.8 Cg_exo -71.26 -18.09 30.54 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.248 1.966 . . . . 0.0 113.124 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.482 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -88.69 -15.45 34.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.616 0.246 . . . . 0.0 111.414 -178.434 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.872 HD21 HD21 ' A' ' 102' ' ' LEU . 3.3 tp -57.88 -52.8 63.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.239 0.543 . . . . 0.0 110.507 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.572 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -68.14 -29.4 68.29 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.651 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 1.6 mtpt -75.69 -30.39 59.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.072 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.9 m -78.85 -38.01 38.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.92 90.5 2.13 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.389 177.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.3 mt -134.23 148.54 50.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.848 0.356 . . . . 0.0 111.084 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.47 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -134.45 138.25 29.67 Favored Pre-proline 0 C--N 1.328 -0.331 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.358 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 44.4 Cg_exo -63.88 -1.06 3.07 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.368 2.712 . . . . 0.0 114.608 -172.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.414 ' O ' ' HD2' ' A' ' 108' ' ' LYS . 12.7 mm-40 -97.1 -5.88 36.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.039 0.447 . . . . 0.0 110.15 175.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -92.82 116.0 65.8 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.295 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.614 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 17.1 Cg_exo -63.27 141.44 82.1 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.436 2.09 . . . . 0.0 110.411 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.482 HG23 HD12 ' A' ' 110' ' ' ILE . 0.5 OUTLIER -138.58 146.28 26.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 121.091 0.472 . . . . 0.0 111.384 -175.246 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.512 HG13 HD12 ' A' ' 42' ' ' LEU . 1.5 p -119.91 142.9 33.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 172.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 5.3 m -102.85 127.43 56.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.038 0.447 . . . . 0.0 110.732 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.966 ' HB2' HD11 ' A' ' 42' ' ' LEU . 3.7 t80 -113.47 151.95 30.78 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.5 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' CYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 88' ' ' PHE . 5.4 p . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.526 -176.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.231 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.439 ' HB1' ' HB1' ' A' ' 18' ' ' ALA . . . -59.28 -36.75 76.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.132 176.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -67.17 -36.8 82.56 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.824 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . 0.64 ' HA ' ' HZ ' ' B' ' 11' ' ' PHE . . . -74.47 -47.96 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.46 . . . . 0.0 110.644 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.864 ' HA3' ' HE3' ' A' ' 22' ' ' MET . . . -69.77 -52.99 17.38 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.666 -0.697 . . . . 0.0 113.626 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.39 -30.7 71.79 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.66 -0.318 . . . . 0.0 111.372 -175.21 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.449 HG22 ' CE2' ' A' ' 105' ' ' TYR . 47.3 m -73.05 -37.95 66.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.362 . . . . 0.0 110.846 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.872 HD21 HD21 ' A' ' 74' ' ' LEU . 12.8 mt -64.2 -46.11 85.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.153 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.37 -26.49 68.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 110.349 177.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -72.98 -9.21 58.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.491 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.449 ' CE2' HG22 ' A' ' 101' ' ' THR . 20.9 m-85 -106.03 -18.46 14.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 0.0 110.6 177.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 117.04 54.95 0.31 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.875 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.522 ' CE1' HD22 ' A' ' 102' ' ' LEU . 1.1 m-85 -94.47 167.92 11.2 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.711 -0.287 . . . . 0.0 110.261 176.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.456 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.4 tttt -77.17 -98.37 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.83 0.348 . . . . 0.0 111.303 -176.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.456 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -107.04 121.71 45.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.524 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.482 HD12 HG23 ' A' ' 85' ' ' VAL . 1.0 OUTLIER -121.91 126.77 74.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.49 0.662 . . . . 0.0 111.477 -174.775 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.47 147.53 44.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.254 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -117.71 144.78 44.94 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.5 131.3 36.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.473 0.654 . . . . 0.0 111.348 -172.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.409 ' HA ' ' OE1' ' A' ' 114' ' ' GLU . 3.8 tp10 -98.2 3.8 48.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.511 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.82 -92.9 2.28 Favored Glycine 0 N--CA 1.443 -0.84 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.203 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 89' ' ' CYS . . . 141.32 161.44 8.71 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' MET . . . . . 0.547 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -56.97 -41.38 78.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.115 0.457 . . . . 0.0 110.954 -176.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -69.37 -27.61 65.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.424 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -72.65 -32.49 65.9 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.761 176.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.574 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 41.5 t-105 -56.99 -47.28 81.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.44 -38.22 86.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.753 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 119' ' ' LYS . 64.6 mt-10 -65.67 -37.3 86.12 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.558 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.601 ' OE1' ' HG3' ' A' ' 28' ' ' LYS . 15.5 mt-10 -83.58 4.08 29.81 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 70.48 28.8 70.61 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.344 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.482 HD21 ' HG2' ' A' ' 28' ' ' LYS . 71.7 mt -85.83 158.88 55.84 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-O 120.516 0.198 . . . . 0.0 110.513 -178.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.25 119.06 6.06 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.415 2.743 . . . . 0.0 112.564 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.4 m -133.19 158.31 43.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.032 0.444 . . . . 0.0 111.459 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.69 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 1.1 mt -113.97 111.31 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.295 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 . . . . . 0 C--N 1.319 -0.742 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.88 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' MET . . . . . 0.561 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mmm . . . . . 0 CA--C 1.52 -0.19 0 CA-C-O 120.673 0.273 . . . . 0.0 111.469 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' GLY . . . . . 0.698 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.45 -36.26 76.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.474 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.67 -32.29 73.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.857 0.361 . . . . 0.0 111.027 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -63.51 -48.12 78.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.994 -176.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.698 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.7 p90 -90.62 -22.46 21.2 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.192 -177.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . 0.572 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -53.67 -47.43 70.41 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.986 0.422 . . . . 0.0 110.756 -177.153 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.9 -43.6 98.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.107 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.45 -42.57 92.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.522 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' PHE . . . . . 0.64 ' HZ ' ' HA ' ' A' ' 98' ' ' ALA . 0.2 OUTLIER -55.59 -50.41 70.16 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.006 0.431 . . . . 0.0 111.107 -176.797 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' B' ' 12' ' ' LYS . 20.9 tptt -69.68 -23.66 63.48 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.191 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.71 75.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -71.43 -50.14 34.78 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.229 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.73 -34.59 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.242 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -63.07 -31.97 73.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.529 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.32 -26.21 64.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 0.0 111.193 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.27 -45.6 83.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.702 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' B' ' 16' ' ' LYS . 1.1 ptmt -75.3 -21.01 58.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.099 0.476 . . . . 0.0 111.067 176.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -17.14 60.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.543 -178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.4 -19.73 60.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.92 0.391 . . . . 0.0 111.554 -177.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' MET . . . . . 0.729 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 2.6 ptm -120.86 -179.54 4.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.758 0.313 . . . . 0.0 110.916 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.34 106.71 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.109 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.41 103.56 4.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.186 0.517 . . . . 0.0 110.267 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' B' ' 25' ' ' LEU . 1.5 mt -116.0 141.35 48.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.885 -178.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.45 144.37 43.09 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.374 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.473 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 3.9 Cg_exo -40.68 -34.13 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 124.814 3.676 . . . . 0.0 115.402 -174.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.524 ' HE3' ' HB3' ' B' ' 123' ' ' GLU . 1.5 mttt -74.47 -44.04 53.38 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.672 0.669 . . . . 0.0 111.266 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.24 -33.38 75.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.247 0.546 . . . . 0.0 110.15 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.79 52.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.821 177.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' TYR . . . . . 0.557 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.6 t80 -63.96 -32.9 74.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.522 0.201 . . . . 0.0 111.037 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -54.59 -53.73 50.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.898 -179.741 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.461 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -74.78 -27.69 60.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.156 179.086 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.557 ' HB2' ' HA ' ' B' ' 31' ' ' TYR . 6.2 mt -62.45 -56.59 16.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.002 0.429 . . . . 0.0 111.418 -178.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -77.36 -21.71 52.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.222 -174.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -91.05 -27.94 18.28 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.578 -177.447 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -120.42 93.31 48.21 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . 0.511 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 31.5 Cg_exo -64.68 3.64 0.84 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 123.229 2.619 . . . . 0.0 114.067 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' B' ' 83' ' ' LYS . 20.4 t70 -92.18 -22.45 19.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.555 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 53.5 mt -78.31 107.66 10.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.751 174.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.534 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.6 OUTLIER -97.28 145.05 26.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.36 -175.95 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.886 HD11 ' HB2' ' B' ' 88' ' ' PHE . 11.1 tp -104.76 125.49 50.89 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.423 HD11 HD11 ' B' ' 79' ' ' LEU . 1.1 mp -102.33 116.61 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 175.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.754 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.72 121.5 41.76 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -176.445 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -110.39 96.48 4.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . 0.628 ' NE ' ' HA ' ' B' ' 46' ' ' ARG . 1.7 tpm_? -150.59 155.91 40.34 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.376 -175.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.1 136.55 79.29 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.72 -177.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 -30.57 91.09 Favored 'Trans proline' 0 N--CA 1.466 -0.126 0 C-N-CA 122.742 2.294 . . . . 0.0 112.513 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -73.24 -42.88 62.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.949 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -33.2 75.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.181 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.737 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 tp -62.11 -33.87 75.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.629 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -70.2 -40.28 74.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.77 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.67 -41.49 13.34 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 3.1 mtp -97.65 -34.14 11.05 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.655 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 113.07 177.95 19.55 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.205 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' LYS . . . . . 0.737 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -147.24 160.72 38.81 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . 0.468 ' HD2' ' HB2' ' B' ' 56' ' ' LYS . 11.9 Cg_endo -60.53 130.52 33.93 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.019 1.813 . . . . 0.0 112.887 -178.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . 0.419 ' HB2' ' C ' ' B' ' 127' ' ' SER . 48.0 t0 -92.34 97.69 11.03 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 173.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.647 HG23 ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -139.83 159.41 27.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.29 -175.879 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -28.29 36.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.255 -176.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.511 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 13.4 p-10 -130.02 69.98 1.44 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.342 0.591 . . . . 0.0 111.633 -174.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' TYR . . . . . 0.754 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -136.45 142.53 43.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.274 176.696 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.722 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 34.2 mttm -127.69 121.9 31.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 -177.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -76.93 129.23 35.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.529 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' MET . . . . . 0.871 ' HB3' ' HB2' ' B' ' 70' ' ' LEU . 14.6 mmt . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.721 174.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.871 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.467 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.606 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.89 -57.08 11.03 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.09 -175.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.486 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 9.6 Cg_exo -71.63 -17.67 29.57 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.21 1.94 . . . . 0.0 112.35 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.527 HD22 ' HA ' ' B' ' 73' ' ' LEU . 0.2 OUTLIER -80.51 -22.81 40.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.878 0.37 . . . . 0.0 110.131 177.348 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.916 HD21 HD21 ' B' ' 102' ' ' LEU . 4.6 tp -57.19 -52.02 66.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.31 177.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.654 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.441 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -71.46 -25.75 62.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.904 0.383 . . . . 0.0 111.019 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' SER . . . . . 0.722 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 47.7 m -78.19 -41.6 34.1 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.224 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.16 60.26 1.33 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.65 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.423 HD11 HD11 ' B' ' 43' ' ' ILE . 7.6 mt -94.72 151.15 19.51 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.0 OUTLIER -122.26 130.52 24.66 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' PRO . . . . . 0.437 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 59.5 Cg_exo -60.63 -6.95 6.39 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.697 2.931 . . . . 0.0 114.935 -171.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -90.6 -7.51 52.57 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.827 -0.545 . . . . 0.0 110.389 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 4.3 mttp -82.02 126.09 75.75 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.607 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.555 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 5.9 Cg_exo -72.24 122.16 8.13 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.192 1.928 . . . . 0.0 109.969 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 13.0 m -127.62 153.21 36.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.101 0.477 . . . . 0.0 111.565 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.406 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 1.4 p -124.28 143.05 39.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 176.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 m -106.43 122.94 60.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.8 0.333 . . . . 0.0 110.513 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' PHE . . . . . 0.886 ' HB2' HD11 ' B' ' 42' ' ' LEU . 0.3 OUTLIER -91.69 123.58 35.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.852 -178.845 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -168.621 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 -0.211 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 96' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' B' ' 100' ' ' LYS . . . -59.57 -34.29 72.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.172 177.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -72.94 -35.23 66.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.811 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 98' ' ' ALA . . . . . 0.559 ' HA ' ' HZ ' ' A' ' 11' ' ' PHE . . . -71.4 -44.18 65.42 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.034 0.445 . . . . 0.0 110.561 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 99' ' ' GLY . . . . . 0.428 ' HA3' ' HE1' ' B' ' 22' ' ' MET . . . -76.02 -51.47 6.91 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.424 -177.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 100' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' B' ' 104' ' ' GLU . 0.0 OUTLIER -62.8 -31.77 72.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.907 0.353 . . . . 0.0 111.268 -174.791 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . 0.5 HG22 ' CE2' ' B' ' 105' ' ' TYR . 10.8 m -73.03 -35.78 66.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.735 0.302 . . . . 0.0 110.98 175.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 102' ' ' LEU . . . . . 0.916 HD21 HD21 ' B' ' 74' ' ' LEU . 6.8 mt -62.65 -49.98 73.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.144 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 103' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -64.44 -27.01 68.7 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.874 0.368 . . . . 0.0 110.409 178.208 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' B' ' 100' ' ' LYS . 4.7 tt0 -71.14 -8.42 53.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.029 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . 0.518 ' CZ ' ' HB ' ' A' ' 10' ' ' THR . 21.4 m-30 -112.01 -8.09 14.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.778 0.323 . . . . 0.0 111.117 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.66 49.7 0.34 Allowed Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.127 -1.035 . . . . 0.0 112.98 174.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 107' ' ' PHE . . . . . 0.572 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.0 m-85 -99.43 149.26 23.38 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 108' ' ' LYS . . . . . 0.447 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -63.01 -91.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.42 -175.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.447 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.9 OUTLIER -116.36 122.25 44.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.34 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 110' ' ' ILE . . . . . 0.567 HG12 ' HE3' ' B' ' 22' ' ' MET . 1.2 tt -120.22 129.13 75.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.275 0.559 . . . . 0.0 111.285 -175.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 111' ' ' TYR . . . . . 0.406 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 1.2 m-85 -116.59 148.68 40.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.067 -177.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.729 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 10.3 t-20 -115.52 143.09 45.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.445 ' HB3' ' HA ' ' B' ' 88' ' ' PHE . 13.7 p -80.97 133.97 35.61 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.425 0.631 . . . . 0.0 111.511 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -86.18 123.34 31.35 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.507 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . 0.726 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 97.2 -79.29 0.67 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.673 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 116' ' ' GLY . . . . . 0.423 ' O ' ' HB2' ' B' ' 119' ' ' LYS . . . 150.27 -175.89 29.13 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.915 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 117' ' ' MET . . . . . 0.733 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -61.87 -27.47 68.81 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.933 0.493 . . . . 0.0 111.697 -176.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.425 ' O ' ' HG3' ' B' ' 122' ' ' GLU . 7.5 p-10 -67.85 -24.29 65.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 119' ' ' LYS . . . . . 0.726 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -72.18 -32.86 67.2 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.783 178.273 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 120' ' ' TRP . . . . . 0.773 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 23.7 t-105 -55.57 -48.77 74.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.956 0.407 . . . . 0.0 109.973 176.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' B' ' 121' ' ' LEU . 0.8 OUTLIER -65.52 -37.76 87.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.756 176.297 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.445 ' HB2' ' HA ' ' B' ' 119' ' ' LYS . 21.0 mt-10 -67.9 -41.26 82.98 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -176.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . 0.68 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 3.9 mm-40 -74.02 -7.84 53.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.342 . . . . 0.0 110.992 -178.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.28 25.95 58.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.29 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.572 ' HG ' ' HB2' ' B' ' 123' ' ' GLU . 58.9 mt -80.44 159.97 68.57 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.56 0.219 . . . . 0.0 110.516 -178.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.525 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 18.5 Cg_endo -56.81 116.89 3.52 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.057 2.505 . . . . 0.0 112.121 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 127' ' ' SER . . . . . 0.419 ' C ' ' HB2' ' B' ' 58' ' ' ASP . 0.0 OUTLIER -126.86 149.18 49.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.461 -177.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.32 -0.685 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.252 0 CA-C-O 120.753 0.311 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.763 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -55.7 -29.9 55.3 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.95 -177.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -39.81 79.58 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.799 0.333 . . . . 0.0 110.665 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -66.98 -58.45 4.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.562 -174.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.763 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 3.4 p90 -68.09 -25.32 65.27 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.975 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.25 -50.78 64.11 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.47 -45.34 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.787 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -47.53 77.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.796 0.331 . . . . 0.0 110.993 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.47 ' CD1' ' HB3' ' B' ' 71' ' ' GLU . 0.7 OUTLIER -57.12 -42.86 81.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.282 0.563 . . . . 0.0 109.787 179.027 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.24 -29.27 70.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.596 177.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.9 54.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.523 -178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -72.41 -49.38 34.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.027 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 t -60.51 -41.16 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -176.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -65.87 -27.6 68.34 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.65 -26.08 68.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.062 0.458 . . . . 0.0 111.099 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.15 -31.58 72.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.423 -178.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.502 ' HD2' ' SD ' ' A' ' 24' ' ' MET . 2.4 pttt -75.03 -20.18 59.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.908 0.385 . . . . 0.0 111.614 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -23.55 57.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.418 -177.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -85.61 4.56 35.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -175.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -145.56 162.77 36.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.65 0.262 . . . . 0.0 110.829 178.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 20.8 t -77.29 113.01 15.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.811 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.502 ' SD ' ' HD2' ' A' ' 19' ' ' LYS . 0.3 OUTLIER -79.26 112.99 17.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.487 179.733 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.62 145.28 49.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.086 0.469 . . . . 0.0 110.52 -178.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.36 141.45 36.92 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.168 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.11 -22.72 5.54 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 124.07 3.18 . . . . 0.0 114.997 -174.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.509 ' HD2' ' HA ' ' A' ' 28' ' ' LYS . 2.1 mmmm -73.65 -44.14 57.63 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.825 -0.547 . . . . 0.0 110.891 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.555 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 10.5 t0 -72.7 -37.29 67.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.853 176.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.48 -46.72 84.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.15 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.43 ' CE1' HG12 ' A' ' 59' ' ' VAL . 80.4 t80 -63.63 -42.8 98.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.804 -177.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -66.45 -41.54 88.97 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.813 -173.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 29' ' ' ASP . 0.3 OUTLIER -72.35 -27.38 62.38 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.598 176.082 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.611 HD11 ' HB2' ' A' ' 42' ' ' LEU . 1.9 mt -59.1 -50.56 73.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.767 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -76.26 -34.67 59.16 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.159 -177.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -70.47 -22.73 62.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.613 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -115.81 140.28 25.95 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-O 121.06 0.457 . . . . 0.0 111.659 -177.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.82 -9.4 10.93 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.778 2.318 . . . . 0.0 111.579 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.503 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -92.34 -67.02 0.88 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.299 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.753 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 52.3 mt -41.97 102.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.439 -175.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.797 HG21 ' HE2' ' A' ' 63' ' ' LYS . 26.4 m -101.85 145.09 29.68 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.271 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.991 HD11 ' HB2' ' A' ' 88' ' ' PHE . 18.1 tp -104.16 127.18 51.74 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.799 HD11 HD11 ' A' ' 79' ' ' LEU . 4.5 mt -106.69 114.57 46.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.784 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -100.41 135.78 41.31 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.627 -177.671 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -114.68 96.77 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 121.994 0.902 . . . . 0.0 109.809 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.682 ' NE ' ' HA ' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -143.4 142.52 31.27 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.611 177.468 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -71.94 140.34 83.36 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -174.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -52.76 -27.41 34.02 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 123.585 2.857 . . . . 0.0 114.362 -168.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.684 ' HB3' ' HB3' ' B' ' 49' ' ' ASP . 0.7 OUTLIER -79.92 -31.62 40.11 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.903 178.403 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -36.92 72.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.982 0.42 . . . . 0.0 110.105 176.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.56 HD13 ' HB3' ' A' ' 46' ' ' ARG . 1.6 tp -60.65 -33.9 73.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.416 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.2 mttt -70.79 -38.59 73.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.261 177.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.83 -48.02 19.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.548 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 21.8 mmm -102.64 -34.02 9.23 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.556 -173.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 121.61 179.63 16.06 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.299 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.477 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -132.81 150.98 77.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.422 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 37.9 Cg_exo -62.34 134.91 50.93 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.514 2.143 . . . . 0.0 113.021 -176.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.475 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 26.9 t70 -101.26 92.35 4.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.699 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 62' ' ' TYR . 5.3 m -133.63 159.31 42.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.068 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -57.35 -41.42 80.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.303 -177.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.536 ' HB2' ' HA ' ' A' ' 41' ' ' THR . 0.1 OUTLIER -121.4 82.33 1.92 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.745 -177.305 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.784 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 3.2 t80 -120.31 125.94 49.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.797 ' HE2' HG21 ' A' ' 41' ' ' THR . 11.3 mttm -122.13 120.62 34.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.016 0.436 . . . . 0.0 110.123 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.425 ' HD2' ' O ' ' A' ' 44' ' ' ASP . 12.9 t-160 -88.24 128.32 35.46 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.233 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.321 -0.65 0 CA-C-O 121.075 0.465 . . . . 0.0 109.761 175.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.603 HD21 ' CZ ' ' B' ' 11' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.256 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.863 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.1 mt-10 -47.35 -62.08 2.36 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.162 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.863 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 3.4 Cg_exo -75.12 -17.36 19.36 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.493 2.129 . . . . 0.0 113.711 178.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -90.0 -27.51 19.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -173.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.514 HD12 HD12 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -69.52 -28.84 66.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.23 0.538 . . . . 0.0 110.384 -177.557 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.433 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -76.91 -33.26 57.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.224 173.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . 0.651 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 11.4 mttt -62.69 -29.77 70.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.86 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -41.07 24.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.695 0.283 . . . . 0.0 110.874 -177.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.49 52.07 2.07 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.582 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.799 HD11 HD11 ' A' ' 43' ' ' ILE . 3.5 mt -75.81 143.58 41.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.407 0.146 . . . . 0.0 110.636 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.484 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -114.19 136.06 22.21 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.665 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 80' ' ' ASP . 25.6 Cg_exo -69.57 1.01 4.68 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.842 2.361 . . . . 0.0 114.06 -172.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.651 ' HA ' ' HD2' ' A' ' 108' ' ' LYS . 3.9 mt-10 -99.89 -7.1 25.7 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 121.996 -0.44 . . . . 0.0 110.715 178.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -84.19 118.65 71.77 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.277 177.485 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.753 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 8.4 Cg_exo -67.79 108.86 1.76 Allowed 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.45 2.1 . . . . 0.0 110.16 174.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.554 HG12 ' HB ' ' A' ' 41' ' ' THR . 9.0 m -114.64 154.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.292 0.568 . . . . 0.0 111.576 -172.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.536 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 1.5 p -123.85 142.56 40.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.264 177.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.856 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 6.0 m -108.46 126.09 65.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.991 ' HB2' HD11 ' A' ' 42' ' ' LEU . 3.7 t80 -100.83 126.21 47.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.947 -0.569 . . . . 0.0 112.062 -171.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' CYS . . . . . 0.776 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.964 0 O-C-N 124.957 1.411 . . . . 0.0 110.934 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.856 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.463 0.197 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.95 -29.57 60.36 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.16 -34.49 71.01 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.829 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.89 61.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.915 0.388 . . . . 0.0 110.749 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.42 -53.23 3.91 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.945 -175.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.435 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -61.49 -33.39 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 122.545 -0.385 . . . . 0.0 111.763 -172.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.435 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 3.5 m -71.55 -36.39 70.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 110.921 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 102' ' ' LEU . 15.0 mt -69.92 -44.2 70.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.568 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.534 ' HA ' ' HB2' ' A' ' 107' ' ' PHE . 0.0 OUTLIER -63.91 -31.51 72.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.75 0.309 . . . . 0.0 110.735 -179.037 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.09 -5.22 50.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.262 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -103.41 -10.51 18.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.052 177.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.21 1.27 3.24 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 119.753 -1.213 . . . . 0.0 113.93 174.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.534 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 8.0 m-85 -67.69 136.82 54.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.212 0.506 . . . . 0.0 110.403 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.651 ' HD2' ' HA ' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -67.12 -81.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.715 -174.327 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.412 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -112.19 113.59 25.92 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.825 -177.106 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 0.7 OUTLIER -117.23 127.7 74.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.212 0.529 . . . . 0.0 110.479 -179.67 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.536 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 13.6 m-85 -112.69 145.0 41.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.996 -176.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -112.0 136.68 51.03 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.533 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 16.4 m -91.73 117.63 29.93 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -55.94 121.6 9.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.733 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 86.84 -108.34 3.32 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.983 -177.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . 0.484 ' CA ' ' HA ' ' A' ' 89' ' ' CYS . . . 159.06 -154.83 25.9 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.034 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' MET . . . . . 0.438 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 16.7 ttp -50.67 -33.65 23.44 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.844 0.457 . . . . 0.0 111.748 -177.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.53 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 27.0 t70 -58.43 -40.37 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.084 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -73.96 -31.94 63.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.632 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.726 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 22.5 t-105 -59.51 -53.86 53.27 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.23 -38.91 91.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.95 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -66.21 -44.8 82.84 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -81.78 20.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -175.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 65.66 24.8 71.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.251 -0.5 . . . . 0.0 113.153 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 120' ' ' TRP . 17.6 mt -83.44 152.05 63.37 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.852 0.358 . . . . 0.0 110.702 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.475 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 33.8 Cg_endo -66.01 118.71 5.73 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.79 2.326 . . . . 0.0 112.835 -176.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.76 149.84 42.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.434 175.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.403 ' CB ' ' HD2' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -102.61 124.9 48.99 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.514 -177.631 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--N 1.323 -0.583 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.558 179.489 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.276 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' GLY . . . . . 0.612 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.14 -35.21 63.93 Favored Glycine 0 C--O 1.224 -0.476 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.921 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -33.61 58.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.841 0.353 . . . . 0.0 111.258 178.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -68.19 -56.46 8.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.612 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.9 OUTLIER -74.46 -22.27 59.18 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.583 -177.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 1.1 t70 -53.11 -50.1 65.15 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.819 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.21 -38.56 77.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.428 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -46.4 64.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 0.0 110.619 178.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' PHE . . . . . 0.603 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -56.01 -48.85 75.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.451 -179.158 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -62.47 -26.13 68.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.534 179.08 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.7 -44.4 56.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.068 0.461 . . . . 0.0 111.409 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.3 -49.83 31.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.902 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.9 t -64.09 -34.27 67.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.319 -175.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.621 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -64.02 -27.89 69.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.552 0.215 . . . . 0.0 111.345 178.747 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -25.57 68.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.94 0.4 . . . . 0.0 110.887 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.65 -32.5 64.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.882 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -78.15 -23.08 47.86 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.481 0.658 . . . . 0.0 110.366 171.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.58 -18.88 58.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.803 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -79.89 -2.29 42.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.282 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' MET . . . . . 0.548 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 1.0 OUTLIER -139.63 172.72 12.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 111.076 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 17.6 t -82.09 112.44 19.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.729 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' MET . . . . . 0.634 ' SD ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -72.7 100.47 2.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.764 -0.198 . . . . 0.0 110.524 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' B' ' 113' ' ' SER . 1.2 mt -117.68 134.2 55.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.146 0.498 . . . . 0.0 110.449 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.38 152.33 70.25 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.567 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 6.9 Cg_endo -51.72 -20.93 10.3 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 123.661 2.907 . . . . 0.0 114.701 -174.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.497 ' HA ' ' HD2' ' B' ' 28' ' ' LYS . 5.8 mmmm -75.44 -48.01 24.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.102 0.477 . . . . 0.0 110.975 176.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.81 -31.37 64.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.689 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.14 -43.92 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.63 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' TYR . . . . . 0.437 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 89.3 t80 -68.55 -31.7 71.11 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.065 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -53.7 55.15 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.054 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.513 HD13 HD13 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -74.46 -27.33 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.134 179.779 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.711 HD11 ' HB2' ' B' ' 42' ' ' LEU . 5.7 mt -57.74 -55.0 40.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.06 -177.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . 0.886 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 15.6 mm100 -74.59 -19.03 60.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.907 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -35.08 15.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.754 0.312 . . . . 0.0 111.478 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 1.2 m-80 -92.43 127.33 49.09 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -76.76 -9.55 18.33 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.632 2.221 . . . . 0.0 111.285 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . 0.422 ' CG ' ' HG3' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -90.99 -69.45 0.73 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 177.168 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.759 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 53.6 mt -44.11 109.75 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.833 -175.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.609 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -106.49 145.75 31.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.003 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.711 ' HB2' HD11 ' B' ' 34' ' ' LEU . 13.9 tp -102.44 124.41 47.97 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 96.4 mt -103.84 113.11 39.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.817 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.91 137.43 39.3 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.221 -177.434 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -115.34 97.19 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 121.87 0.843 . . . . 0.0 110.04 175.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . 0.59 ' NE ' ' HA ' ' B' ' 46' ' ' ARG . 0.8 OUTLIER -148.41 134.29 19.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.423 177.715 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -69.83 147.63 96.2 Favored Pre-proline 0 C--N 1.318 -0.78 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.056 -171.22 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -49.9 -32.74 31.14 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 124.055 3.17 . . . . 0.0 113.869 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.684 ' HB3' ' HB3' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -71.25 -43.05 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.724 0.297 . . . . 0.0 110.896 -179.407 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 8.0 mt-10 -67.27 -36.97 82.67 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.7 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.408 ' CD1' ' HB3' ' B' ' 46' ' ' ARG . 0.5 OUTLIER -61.8 -34.58 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.796 177.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -72.79 -41.43 64.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.928 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.02 -48.47 16.09 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -173.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -99.48 -35.63 9.82 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.628 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.62 -175.93 16.11 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.616 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.61 160.27 64.11 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . 0.436 ' HB3' ' CZ2' ' B' ' 120' ' ' TRP . 25.5 Cg_exo -63.0 124.86 14.72 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.223 1.949 . . . . 0.0 112.913 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . 0.827 ' HB3' ' HB2' ' B' ' 126' ' ' PRO . 25.6 t70 -90.35 88.06 7.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.013 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.6 m -134.98 167.51 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . 0.886 ' HD2' ' HA ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -76.04 -27.84 57.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.929 0.395 . . . . 0.0 111.17 -176.88 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -122.65 68.77 0.97 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.458 -175.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' TYR . . . . . 0.817 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.3 t80 -121.79 127.49 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.816 0.341 . . . . 0.0 110.345 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.723 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 61.8 mttm -122.83 122.33 38.41 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 177.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -88.87 133.18 34.37 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 -177.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' MET . . . . . 0.536 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.474 0 CA-C-O 121.085 0.469 . . . . 0.0 110.796 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.735 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.617 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.735 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -54.38 -46.56 98.99 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -174.659 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.535 ' HD3' ' OE1' ' B' ' 71' ' ' GLU . 58.3 Cg_endo -71.18 -20.14 28.72 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.333 1.355 . . . . 0.0 111.921 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.536 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -86.33 -26.47 24.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.189 0.518 . . . . 0.0 110.015 177.404 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.943 HD21 HD21 ' B' ' 102' ' ' LEU . 4.6 tp -58.0 -52.75 64.21 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.958 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.69 -28.49 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.636 -175.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -91.75 -13.48 31.51 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.361 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' SER . . . . . 0.723 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 20.3 m -72.86 -27.67 62.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.897 0.38 . . . . 0.0 110.5 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . 0.42 ' O ' ' HE3' ' B' ' 63' ' ' LYS . . . 90.77 64.02 1.21 Allowed Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.433 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.2 mt -113.31 140.69 47.79 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.649 0.262 . . . . 0.0 110.406 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.87 ' HB3' ' HE3' ' B' ' 83' ' ' LYS . 3.3 t70 -114.55 133.03 22.58 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' PRO . . . . . 0.611 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 10.0 Cg_endo -57.6 -10.03 6.37 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.599 2.866 . . . . 0.0 115.266 -171.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.412 ' H ' ' HG3' ' B' ' 82' ' ' GLU . 0.0 OUTLIER -93.54 -10.53 34.52 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.679 -0.638 . . . . 0.0 110.924 179.825 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' LYS . . . . . 0.87 ' HE3' ' HB3' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -78.7 121.2 83.26 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.534 -177.407 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.759 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 4.8 Cg_exo -72.87 117.47 5.14 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.436 2.091 . . . . 0.0 109.984 173.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 12.3 m -121.1 158.24 23.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-O 121.313 0.578 . . . . 0.0 111.457 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.97 140.6 44.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . 0.955 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 1.8 m -110.84 122.48 65.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.122 0.487 . . . . 0.0 110.13 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' PHE . . . . . 0.772 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -81.34 161.39 23.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.376 -175.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 171.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . 0.955 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.53 0.173 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.03 -29.36 63.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.787 -176.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 97' ' ' LEU . . . . . 0.467 HD13 ' HA ' ' B' ' 97' ' ' LEU . 2.4 mm? -76.98 -31.33 56.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.819 0.343 . . . . 0.0 110.879 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.88 -35.1 62.31 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.025 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -94.7 -54.92 1.47 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.443 -0.884 . . . . 0.0 114.273 -174.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -28.44 67.87 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 122.399 -0.471 . . . . 0.0 111.981 -171.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.53 -35.83 70.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.892 0.377 . . . . 0.0 111.109 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 102' ' ' LEU . . . . . 0.943 HD21 HD21 ' B' ' 74' ' ' LEU . 15.4 mt -63.81 -46.61 84.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.751 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 103' ' ' ARG . . . . . 0.554 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.0 OUTLIER -66.02 -26.86 67.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.833 0.349 . . . . 0.0 110.725 -179.215 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.02 -6.16 36.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.219 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -110.56 -9.2 14.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.221 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 130.28 5.18 4.28 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.918 -1.134 . . . . 0.0 113.58 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 107' ' ' PHE . . . . . 0.611 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 5.9 m-85 -66.05 135.35 54.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.177 0.489 . . . . 0.0 110.276 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 6.3 mttt -61.24 -84.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.563 -174.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.35 119.13 35.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.095 0.474 . . . . 0.0 110.837 -178.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 110' ' ' ILE . . . . . 0.486 HG21 ' HG2' ' B' ' 103' ' ' ARG . 0.4 OUTLIER -117.34 128.38 74.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-O 121.177 0.513 . . . . 0.0 110.588 -178.192 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -115.41 146.56 41.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.121 -175.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.634 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 4.5 t-20 -114.47 141.9 47.09 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.508 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 14.6 m -86.9 105.58 17.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.25 0.548 . . . . 0.0 111.611 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 21.75 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.929 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -116.44 -66.44 0.38 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.182 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 123.53 170.48 13.4 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.444 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 117' ' ' MET . . . . . 0.526 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 1.0 OUTLIER -63.16 -34.71 78.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.021 0.439 . . . . 0.0 110.484 -179.549 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -62.1 -31.13 71.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.053 178.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 119' ' ' LYS . . . . . 0.567 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -72.81 -32.12 65.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.963 179.392 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 120' ' ' TRP . . . . . 0.772 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.7 t-105 -60.21 -53.86 52.7 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 177.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' B' ' 121' ' ' LEU . 6.5 mt -63.93 -40.92 97.58 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -63.57 -43.85 95.82 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.885 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . 0.407 ' HB3' ' HD3' ' B' ' 28' ' ' LYS . 12.8 mm-40 -72.0 1.38 7.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.672 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.12 27.47 66.25 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.932 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 85.5 mt -82.66 150.99 64.0 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.827 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 13.5 Cg_endo -57.68 128.39 29.02 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 123.084 2.522 . . . . 0.0 112.547 -176.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.81 142.97 46.23 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.294 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.321 -0.636 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.1 mpp? . . . . . 0 N--CA 1.461 0.084 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.738 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -53.52 -32.76 46.41 Favored Glycine 0 C--O 1.226 -0.402 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.876 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.88 -32.55 74.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.994 0.425 . . . . 0.0 111.418 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.4 mmtm -69.79 -57.73 4.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.924 -175.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.738 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 4.9 p90 -77.79 -28.38 50.46 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.311 -0.556 . . . . 0.0 112.165 -174.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -45.0 71.11 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.006 0.431 . . . . 0.0 110.563 -177.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.63 -41.85 95.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.226 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -44.5 75.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.015 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -53.98 -46.84 71.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.264 0.554 . . . . 0.0 110.358 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.95 -26.53 65.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.466 178.235 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.86 -41.45 74.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.981 0.419 . . . . 0.0 110.602 177.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -71.32 -49.78 39.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.445 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.552 HG11 ' HG2' ' B' ' 71' ' ' GLU . 1.1 t -65.63 -35.77 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.951 -174.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.2 mttt -63.57 -30.2 71.35 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.803 0.335 . . . . 0.0 111.184 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.82 -26.37 68.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.145 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.55 -32.94 64.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.97 -178.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -78.42 -23.43 46.69 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.382 0.611 . . . . 0.0 110.582 172.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.01 -18.17 38.01 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.38 -22.26 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.889 -175.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.618 ' HE3' HG12 ' A' ' 110' ' ' ILE . 4.3 ptm -127.43 179.55 5.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.668 0.271 . . . . 0.0 111.018 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.5 t -80.14 108.24 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.471 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.13 121.6 25.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.944 0.402 . . . . 0.0 110.644 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 113' ' ' SER . 3.6 mt -134.73 143.61 47.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.065 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.98 141.88 75.48 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.888 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.652 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 5.8 Cg_endo -49.83 -22.92 7.84 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.825 3.017 . . . . 0.0 114.331 -175.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -45.83 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.076 -0.39 . . . . 0.0 110.642 174.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -68.32 -29.49 68.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.195 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.61 -46.06 49.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.779 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.608 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 66.5 t80 -66.26 -28.53 68.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 0.0 110.768 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -53.58 56.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.517 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -73.43 -27.39 61.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.711 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.625 HD11 ' HB2' ' A' ' 42' ' ' LEU . 1.1 mt -60.71 -55.25 35.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -74.0 -26.75 60.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.028 -176.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -79.08 -40.11 32.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.934 0.397 . . . . 0.0 110.584 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -118.78 100.51 50.97 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.669 -176.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -68.13 5.08 1.25 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.977 2.451 . . . . 0.0 112.394 178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.73 -33.12 23.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.552 174.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.689 HG12 ' HB2' ' A' ' 84' ' ' PRO . 13.9 mt -86.63 106.93 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.389 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.501 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -95.65 146.41 24.51 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.686 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.625 ' HB2' HD11 ' A' ' 34' ' ' LEU . 7.9 tp -98.45 127.62 44.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 83.1 mt -111.86 121.85 65.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -109.3 148.14 31.52 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.226 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.39 98.82 5.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.542 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.413 ' HA ' ' HD2' ' A' ' 46' ' ' ARG . 8.5 mmm-85 -156.28 -170.81 3.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.669 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.43 ' HB3' ' HG3' ' A' ' 50' ' ' GLU . 3.9 t70 -100.02 129.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.843 0.354 . . . . 0.0 110.268 176.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.05 -19.34 65.91 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.684 2.256 . . . . 0.0 113.086 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -72.01 -51.26 22.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.779 0.324 . . . . 0.0 111.061 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HB3' ' CB ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -73.16 -27.6 61.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.338 177.137 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.493 HD22 ' CE1' ' A' ' 64' ' ' HIS . 0.7 OUTLIER -58.98 -46.69 87.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.111 174.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -30.89 71.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.72 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.29 -48.3 11.38 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 36.6 mtm -92.24 -34.45 14.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -171.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 139.19 146.12 4.87 Favored Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.541 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.44 141.52 40.7 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 177.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.425 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 9.4 Cg_endo -56.98 121.9 10.88 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.547 2.165 . . . . 0.0 112.438 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -93.22 93.38 8.21 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.686 HG22 ' HB2' ' A' ' 62' ' ' TYR . 15.9 m -132.07 162.48 39.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.31 83.44 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.501 ' HB2' HG23 ' A' ' 41' ' ' THR . 19.4 p-10 -128.75 79.9 1.94 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.571 0.7 . . . . 0.0 111.286 -174.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.686 ' HB2' HG22 ' A' ' 59' ' ' VAL . 9.3 t80 -122.3 129.86 52.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.279 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.467 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 0.0 OUTLIER -125.07 122.39 37.06 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.183 0.516 . . . . 0.0 110.934 178.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.493 ' CE1' HD22 ' A' ' 51' ' ' LEU . 2.7 t-160 -92.0 116.95 29.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.426 177.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.918 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.611 0 CA-C-O 120.655 0.264 . . . . 0.0 110.791 -176.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.918 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.472 0.674 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.605 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -44.67 -58.5 5.22 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -173.443 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.605 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 13.3 Cg_exo -73.16 -16.95 25.01 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 122.079 1.853 . . . . 0.0 113.209 -175.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.741 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -96.46 -15.33 21.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.651 0.262 . . . . 0.0 110.685 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.736 HD13 HD11 ' A' ' 70' ' ' LEU . 30.6 tp -58.16 -54.95 41.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.168 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.76 -16.41 61.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.838 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -88.58 -17.9 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.467 ' HB2' ' HD2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -100.84 43.85 1.04 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.766 -175.664 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 43.47 64.7 1.73 Allowed Glycine 0 C--N 1.335 0.477 0 O-C-N 123.616 0.573 . . . . 0.0 113.459 175.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 74' ' ' LEU . 8.0 mt -116.32 128.64 55.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.131 0.491 . . . . 0.0 111.033 -177.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -129.82 149.93 74.44 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.809 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.36 17.75 0.28 Allowed 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.889 2.393 . . . . 0.0 113.59 -174.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.21 6.17 10.75 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.083 0.468 . . . . 0.0 110.179 176.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.1 mttm -106.88 133.8 20.12 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.689 ' HB2' HG12 ' A' ' 40' ' ' ILE . 2.5 Cg_endo -77.74 141.54 19.51 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.732 2.288 . . . . 0.0 110.721 175.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.521 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -143.93 148.32 18.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.834 0.349 . . . . 0.0 110.624 -177.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 p -123.86 140.05 48.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.981 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 13.3 m -108.57 134.72 49.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.345 -176.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.834 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.4 t80 -101.06 162.68 12.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.225 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' CYS . . . . . 0.548 ' HA ' ' HA2' ' A' ' 116' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 174.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.981 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.46 0.051 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.84 -31.91 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.697 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.64 -33.69 76.21 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.616 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.18 -49.73 18.54 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.039 0.447 . . . . 0.0 110.913 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . 0.422 ' HA3' ' CE ' ' A' ' 22' ' ' MET . . . -75.79 -51.69 6.93 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.46 -0.791 . . . . 0.0 114.127 -173.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -65.33 -30.57 71.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.914 0.387 . . . . 0.0 111.056 -174.282 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.482 HG22 ' CE2' ' A' ' 105' ' ' TYR . 32.7 m -72.16 -36.75 69.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.912 176.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.53 HD21 HD21 ' A' ' 74' ' ' LEU . 8.1 mt -68.05 -42.91 79.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.517 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 4.0 ptm180 -67.7 -27.24 66.66 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.849 0.357 . . . . 0.0 110.361 179.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.427 ' CD ' ' HZ1' ' A' ' 100' ' ' LYS . 0.5 OUTLIER -69.75 -6.91 35.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.361 174.644 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.522 ' CE1' ' HB ' ' B' ' 10' ' ' THR . 22.5 m-85 -107.4 -12.11 15.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.683 0.278 . . . . 0.0 110.762 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.46 50.98 0.73 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.323 173.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.459 ' CE1' HD22 ' A' ' 102' ' ' LEU . 2.0 m-85 -88.43 -179.84 6.17 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.679 -0.307 . . . . 0.0 110.584 177.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -85.46 -97.02 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.655 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.19 115.91 29.59 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.742 0.305 . . . . 0.0 110.554 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.618 HG12 ' HE3' ' A' ' 22' ' ' MET . 1.5 tt -118.05 127.72 75.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.068 0.461 . . . . 0.0 110.743 -176.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -115.62 144.95 43.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.625 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.582 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 4.1 t-20 -107.87 136.14 48.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 171.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.479 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.1 m -88.45 108.76 19.55 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.704 0.287 . . . . 0.0 111.759 -175.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -58.89 135.59 57.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.296 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 93.1 -106.88 3.47 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.75 -174.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . 0.584 ' H ' ' HB2' ' A' ' 119' ' ' LYS . . . 160.79 -156.97 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' MET . . . . . 0.472 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 2.2 ttm -59.02 -33.68 71.02 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.203 0.525 . . . . 0.0 109.987 177.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.496 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.8 OUTLIER -61.73 -32.28 72.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.014 177.205 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.652 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -74.6 -32.75 62.46 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 122.168 0.187 . . . . 0.0 111.476 178.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.834 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 24.8 t-105 -59.83 -53.32 59.35 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 121' ' ' LEU . 5.5 mt -64.84 -38.94 92.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.967 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.7 OUTLIER -65.51 -35.77 81.85 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.873 0.368 . . . . 0.0 111.483 -178.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.722 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.0 tp10 -79.43 -3.89 48.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.3 29.18 68.74 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 121.056 -0.593 . . . . 0.0 112.041 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.722 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 52.3 mt -80.94 160.65 65.69 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-O 120.679 0.276 . . . . 0.0 110.879 -176.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 21.0 Cg_endo -58.47 117.58 4.32 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.079 2.519 . . . . 0.0 112.47 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.4 m -128.44 146.39 50.82 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.2 mt -99.36 103.1 14.88 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.077 0.465 . . . . 0.0 110.105 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.672 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.676 -179.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' MET . . . . . 0.552 ' HG3' ' HG3' ' B' ' 6' ' ' LYS . 1.9 mpp? . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.738 0.304 . . . . 0.0 111.279 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' GLY . . . . . 0.715 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.31 -39.24 81.9 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.633 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -63.48 -33.04 74.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.299 -0.451 . . . . 0.0 111.421 176.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.552 ' HG3' ' HG3' ' B' ' 3' ' ' MET . 1.7 mmmt -71.27 -52.24 20.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.626 -175.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.715 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 2.2 p90 -82.41 -24.31 34.44 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.267 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.92 -49.49 65.87 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.777 0.322 . . . . 0.0 110.683 -179.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.67 -44.71 77.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.255 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . 0.522 ' HB ' ' CE1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -64.89 -42.86 94.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.938 179.132 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' PHE . . . . . 0.468 ' O ' ' HB ' ' B' ' 15' ' ' VAL . 0.5 OUTLIER -57.85 -47.96 81.17 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.013 0.435 . . . . 0.0 110.428 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' LYS . . . . . 0.607 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.41 -25.9 68.22 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.185 177.597 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.21 -47.53 27.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.101 0.477 . . . . 0.0 111.262 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.89 -50.37 35.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.688 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.468 ' HB ' ' O ' ' B' ' 11' ' ' PHE . 0.5 OUTLIER -60.2 -33.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.633 -176.791 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.607 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.1 OUTLIER -70.8 -38.9 73.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.594 0.235 . . . . 0.0 110.978 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.08 -25.82 64.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.493 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.34 81.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.683 -179.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' B' ' 16' ' ' LYS . 4.9 pttp -77.62 -22.0 51.44 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.293 0.568 . . . . 0.0 110.865 174.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.79 -19.48 52.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.54 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 25.4 t70 -69.18 -25.84 64.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.751 -175.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' MET . . . . . 0.434 ' CE ' ' HA3' ' B' ' 99' ' ' GLY . 12.4 ptm -117.49 179.87 3.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.814 0.34 . . . . 0.0 111.708 -177.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 34.8 t -76.61 113.64 15.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.527 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.04 112.67 21.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.896 -177.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' B' ' 25' ' ' LEU . 4.1 mt -112.39 -169.09 1.41 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.02 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.69 144.65 47.11 Favored Pre-proline 0 C--N 1.317 -0.848 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 173.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.0 -25.14 11.92 Favored 'Trans proline' 0 CA--C 1.531 0.335 0 C-N-CA 123.554 2.836 . . . . 0.0 113.581 -176.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -43.22 59.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.969 0.414 . . . . 0.0 110.72 176.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . 0.464 ' HB3' HD13 ' B' ' 25' ' ' LEU . 0.2 OUTLIER -73.89 -32.97 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.95 178.462 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.617 ' HB1' HG21 ' B' ' 86' ' ' VAL . . . -66.69 -47.33 72.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.734 178.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' TYR . . . . . 0.618 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 71.5 t80 -67.92 -30.53 69.87 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.811 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -55.73 -53.1 60.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.946 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.2 OUTLIER -74.36 -27.05 60.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.813 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.7 HD11 ' HB2' ' B' ' 42' ' ' LEU . 2.9 mt -60.46 -55.9 27.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.024 0.44 . . . . 0.0 111.797 -178.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -76.03 -19.12 58.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.103 -0.499 . . . . 0.0 112.02 -173.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -16.72 18.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.486 -178.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.571 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 10.6 m-80 -121.32 101.24 44.22 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -66.2 -5.51 12.61 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 123.161 2.574 . . . . 0.0 113.416 -176.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . 0.422 ' CG ' ' HZ2' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -98.28 -19.67 17.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.745 0.307 . . . . 0.0 110.84 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.628 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 26.5 mt -82.68 105.24 12.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.926 176.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.672 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -98.72 145.18 27.17 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.05 -176.615 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.957 HD11 ' HB2' ' B' ' 88' ' ' PHE . 12.7 tp -100.91 125.18 47.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 2.0 mt -105.55 115.57 47.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.757 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -101.26 133.66 45.5 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -126.78 98.96 5.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.599 -179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -160.16 154.93 24.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.314 -174.252 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' B' ' 46' ' ' ARG . 0.0 OUTLIER -59.74 144.89 84.75 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 120.986 0.422 . . . . 0.0 111.241 -178.835 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.06 -18.54 35.55 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 123.322 2.681 . . . . 0.0 114.01 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.49 ' CB ' ' HB3' ' A' ' 50' ' ' GLU . 1.0 OUTLIER -74.89 -42.65 57.42 Favored 'General case' 0 CA--C 1.51 -0.568 0 O-C-N 121.867 -0.521 . . . . 0.0 111.296 -178.052 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -66.53 -35.09 79.39 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.799 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.4 mp -56.68 -34.17 67.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.417 176.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -79.31 -41.13 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.032 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.24 -48.06 13.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.476 -172.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -97.7 -34.32 10.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.755 0.312 . . . . 0.0 110.795 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 176.42 14.94 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.009 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' LYS . . . . . 0.799 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.1 OUTLIER -134.67 151.33 75.68 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.054 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -57.18 125.96 20.6 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.762 2.308 . . . . 0.0 112.671 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . 0.808 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 7.4 t0 -100.37 91.47 4.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.335 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.521 HG23 ' H ' ' B' ' 61' ' ' ASN . 2.8 m -128.49 166.39 25.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 176.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -29.14 67.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.824 0.345 . . . . 0.0 111.239 -176.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.588 ' HB2' HG23 ' B' ' 41' ' ' THR . 5.1 p30 -131.22 77.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.261 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' TYR . . . . . 0.757 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.6 OUTLIER -130.42 141.01 50.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.961 178.165 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.672 ' HE2' HG21 ' B' ' 41' ' ' THR . 0.0 OUTLIER -135.31 135.41 40.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.86 0.362 . . . . 0.0 110.675 175.65 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -88.69 118.64 28.51 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' MET . . . . . 0.467 ' HB3' ' HB2' ' B' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.32 -0.676 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.535 HD12 HD13 ' B' ' 74' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.112 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.694 ' HB2' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -45.94 -66.1 0.56 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -174.46 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.694 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 55.3 Cg_endo -74.43 -15.13 22.42 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 121.99 1.794 . . . . 0.0 113.79 -177.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.477 HD22 ' HA ' ' B' ' 73' ' ' LEU . 0.1 OUTLIER -83.04 -15.11 52.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.218 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.964 HD21 HD21 ' B' ' 102' ' ' LEU . 9.0 tp -58.51 -53.84 53.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.975 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.09 -24.94 65.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.73 -25.98 49.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.745 -175.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -106.31 43.99 1.09 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -173.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.75 77.77 0.09 OUTLIER Glycine 0 C--N 1.336 0.566 0 N-CA-C 114.495 0.558 . . . . 0.0 114.495 172.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.426 HD21 ' HE3' ' B' ' 63' ' ' LYS . 53.3 mt -127.59 136.19 51.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.711 0.255 . . . . 0.0 110.697 177.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.475 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 3.5 t0 -135.47 136.63 24.43 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.624 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' PRO . . . . . 0.562 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 32.9 Cg_exo -63.35 11.82 0.09 OUTLIER 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 123.542 2.828 . . . . 0.0 114.828 -173.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.95 -8.53 17.57 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 121.778 -0.576 . . . . 0.0 110.492 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.8 mttp -90.93 134.18 30.75 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.751 -176.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.628 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 1.3 Cg_endo -78.6 121.82 5.28 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.756 2.304 . . . . 0.0 110.198 171.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.531 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.1 OUTLIER -127.23 151.68 34.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 120.959 0.409 . . . . 0.0 111.177 -174.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.617 HG21 ' HB1' ' B' ' 30' ' ' ALA . 1.4 p -125.18 140.19 48.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . 0.934 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 16.6 m -108.25 137.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.342 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' PHE . . . . . 0.957 ' HB2' HD11 ' B' ' 42' ' ' LEU . 8.3 t80 -120.19 143.9 47.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.575 -175.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . 0.403 ' SG ' ' HB2' ' B' ' 46' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.438 0 O-C-N 123.824 0.703 . . . . 0.0 111.31 -177.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . 0.934 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 CA--C 1.529 0.165 0 N-CA-C 111.995 0.368 . . . . 0.0 111.995 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.05 -32.19 69.54 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.101 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -73.44 -26.94 61.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.858 0.361 . . . . 0.0 110.633 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.65 -44.63 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.007 0.432 . . . . 0.0 110.691 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 99' ' ' GLY . . . . . 0.434 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -85.32 -45.46 5.86 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.637 -0.792 . . . . 0.0 114.061 -173.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 100' ' ' LYS . . . . . 0.482 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -64.71 -34.77 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.99 0.424 . . . . 0.0 111.19 -174.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . 0.482 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 3.9 m -72.56 -35.43 67.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.179 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 102' ' ' LEU . . . . . 0.964 HD21 HD21 ' B' ' 74' ' ' LEU . 8.1 mt -67.04 -42.98 83.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -177.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 103' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -65.45 -26.59 68.02 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.08 0.467 . . . . 0.0 110.211 178.5 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.02 -7.38 48.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.701 177.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . 0.428 ' CE2' HG22 ' B' ' 101' ' ' THR . 22.4 m-85 -108.21 -17.55 13.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.634 0.254 . . . . 0.0 110.876 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.73 29.05 1.46 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 119.987 -1.101 . . . . 0.0 113.351 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 107' ' ' PHE . . . . . 0.513 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.7 m-85 -74.36 154.97 38.62 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 108' ' ' LYS . . . . . 0.443 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -66.75 -92.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.065 0.459 . . . . 0.0 111.278 -174.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.443 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.2 OUTLIER -115.28 110.89 20.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.27 -178.935 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 110' ' ' ILE . . . . . 0.531 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.3 tt -112.23 128.58 68.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.035 0.445 . . . . 0.0 110.49 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -117.77 148.13 42.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.734 -174.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -116.77 141.58 48.02 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 16.1 m -91.1 107.44 19.2 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -175.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.48 158.13 34.45 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.021 0.438 . . . . 0.0 110.748 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 90.74 -78.71 1.43 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.76 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 142.27 -170.12 25.14 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.164 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 117' ' ' MET . . . . . 0.597 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 4.0 tpp -66.11 -30.28 70.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 110.32 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.28 -32.28 71.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.971 179.549 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 119' ' ' LYS . . . . . 0.407 ' HD2' ' OD1' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -69.64 -32.61 71.39 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 120' ' ' TRP . . . . . 0.788 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 18.2 t-105 -60.23 -54.86 40.71 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 7.1 mt -66.95 -39.39 87.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.127 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.568 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.9 OUTLIER -63.69 -43.41 96.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.799 -176.885 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . 0.474 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 3.1 tp10 -75.7 -2.95 31.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.25 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.35 30.4 60.6 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.799 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.474 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 52.2 mt -76.64 157.7 81.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.532 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 25.2 Cg_endo -61.52 120.54 8.24 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.849 2.366 . . . . 0.0 112.25 -177.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.22 144.54 38.52 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 128' ' ' LEU . . . . . 0.808 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 19.8 mt . . . . . 0 C--N 1.321 -0.665 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 176.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 120.858 0.361 . . . . 0.0 111.668 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.794 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -50.45 -24.97 7.94 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.513 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.7 -31.91 68.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.901 0.381 . . . . 0.0 111.218 177.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -64.98 -57.24 9.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.098 -175.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.794 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.2 p90 -76.28 -21.23 56.53 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.391 -176.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.602 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 0.7 OUTLIER -52.44 -49.81 63.85 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.348 0.405 . . . . 0.0 110.301 -178.328 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.81 85.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.458 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.5 -45.3 80.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.267 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.516 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.9 OUTLIER -58.97 -47.28 85.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.147 0.498 . . . . 0.0 110.277 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -64.91 -26.64 68.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.289 178.024 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -41.89 61.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.0 0.428 . . . . 0.0 111.618 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -71.09 -49.82 40.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.625 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.3 t -63.01 -34.86 68.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.379 -177.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -68.86 -35.21 76.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.646 0.26 . . . . 0.0 111.25 178.524 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.99 -26.06 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.643 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.0 -35.66 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.501 ' HA ' ' SD ' ' A' ' 22' ' ' MET . 0.8 OUTLIER -74.64 -19.23 60.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.658 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.24 -24.81 59.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.474 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.401 ' O ' ' HD3' ' A' ' 103' ' ' ARG . 8.8 t70 -87.47 17.86 4.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.915 0.388 . . . . 0.0 111.943 -175.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.501 ' SD ' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -144.79 165.2 28.76 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.121 -0.362 . . . . 0.0 111.462 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.1 t -84.03 104.51 12.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.544 174.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.649 ' HB3' ' HG2' ' A' ' 114' ' ' GLU . 0.7 OUTLIER -82.6 114.05 20.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.212 0.529 . . . . 0.0 110.85 -175.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.469 ' HA ' HD23 ' A' ' 25' ' ' LEU . 3.3 mt -122.98 147.05 47.07 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.252 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.6 142.9 78.1 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.177 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.741 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 4.9 Cg_endo -47.59 -31.05 13.31 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.551 2.834 . . . . 0.0 113.553 -178.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -74.05 -41.5 61.66 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 122.188 -0.32 . . . . 0.0 110.763 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HB3' HD13 ' A' ' 25' ' ' LEU . 1.5 m-20 -62.48 -37.44 85.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.233 175.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.13 -46.85 60.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.945 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.649 ' HA ' HD12 ' A' ' 34' ' ' LEU . 88.0 t80 -66.67 -31.46 72.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.945 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -53.0 63.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.001 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.451 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.3 OUTLIER -71.03 -26.31 63.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.896 177.701 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.649 HD12 ' HA ' ' A' ' 31' ' ' TYR . 7.1 mt -60.14 -55.36 34.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.24 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.473 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 0.2 OUTLIER -73.49 -32.11 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.282 -176.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -77.33 -28.59 53.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.95 0.405 . . . . 0.0 111.077 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -125.85 100.7 30.51 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.736 -177.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.19 0.65 3.07 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.028 2.485 . . . . 0.0 112.887 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.68 -24.77 20.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.249 0.547 . . . . 0.0 109.814 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.693 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 55.8 mt -89.11 107.24 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.26 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.561 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.3 OUTLIER -95.11 145.37 25.04 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.513 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 88' ' ' PHE . 5.8 tp -103.36 130.04 50.56 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 92.3 mt -113.83 120.47 63.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.676 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.806 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -102.16 132.35 48.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.437 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -113.84 99.5 8.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.136 -178.664 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.636 ' HD2' ' OE2' ' A' ' 50' ' ' GLU . 3.9 mmt180 -156.51 -177.2 6.42 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.639 ' HB3' ' HD2' ' A' ' 48' ' ' PRO . 63.3 m-20 -111.35 168.98 6.8 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.639 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 55.9 Cg_endo -77.84 -23.44 9.44 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 121.863 1.709 . . . . 0.0 114.454 -168.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.69 -49.64 51.54 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.141 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.636 ' OE2' ' HD2' ' A' ' 46' ' ' ARG . 11.5 pm0 -70.25 -33.53 71.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.576 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.627 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.9 OUTLIER -62.73 -37.33 86.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.117 178.123 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -37.31 84.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.35 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.64 -50.56 10.47 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -172.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -100.3 -33.57 10.35 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.139 -174.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 176.47 14.56 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.799 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.627 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -143.89 158.42 56.05 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.407 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 15.6 Cg_endo -62.83 138.45 68.89 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 121.996 1.797 . . . . 0.0 112.589 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.406 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 3.6 t70 -112.41 94.05 4.74 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.686 177.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.729 HG22 ' HB2' ' A' ' 62' ' ' TYR . 2.0 m -131.95 162.61 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.303 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -55.17 -45.56 75.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.045 -176.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.561 ' HB2' HG23 ' A' ' 41' ' ' THR . 14.0 p30 -122.56 73.48 1.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.76 0.79 . . . . 0.0 111.027 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.806 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.6 t80 -114.95 128.41 56.27 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.981 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HE2' HG21 ' A' ' 41' ' ' THR . 3.4 mtmt -120.46 121.44 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.807 0.337 . . . . 0.0 110.444 177.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -90.14 116.17 27.94 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 176.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.838 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.32 -0.676 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.831 -175.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.789 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.844 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.68 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 0.4 OUTLIER -49.32 -64.84 1.0 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.041 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.68 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 11.4 Cg_exo -73.86 -17.26 22.83 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.205 1.937 . . . . 0.0 113.219 -176.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.838 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.6 OUTLIER -91.52 -29.01 17.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -173.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.68 HD12 HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -62.42 -29.81 70.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.299 0.571 . . . . 0.0 111.411 -177.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.562 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -71.18 -32.75 69.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.697 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.82 -15.33 42.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -174.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -27.39 59.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 -176.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.1 61.07 0.86 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.601 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.68 HD13 HD12 ' A' ' 74' ' ' LEU . 11.1 mt -114.54 146.08 41.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.744 0.307 . . . . 0.0 110.688 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -136.71 150.23 69.43 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.419 176.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.65 17.01 0.47 Allowed 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 123.008 2.472 . . . . 0.0 113.667 -175.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.73 -1.28 19.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.155 0.503 . . . . 0.0 109.765 174.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 9.5 mmtm -100.06 128.73 30.03 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.047 -177.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.693 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 4.7 Cg_exo -74.83 122.17 7.11 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.565 2.177 . . . . 0.0 110.103 173.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.441 HG23 HD12 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -127.32 149.48 32.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 120.988 0.423 . . . . 0.0 111.132 -174.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -122.34 137.88 54.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.246 175.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.539 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 6.4 m -105.81 134.1 48.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.947 ' HB2' HD11 ' A' ' 42' ' ' LEU . 24.9 t80 -118.23 144.15 45.99 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.424 -173.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.472 0.642 0 C-N-CA 123.766 0.826 . . . . 0.0 110.747 -175.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.539 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.462 0.144 0 CA-C-O 121.173 0.511 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.26 -36.72 76.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.556 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 97' ' ' LEU . 3.4 mm? -70.44 -30.05 66.79 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.363 176.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.83 -41.45 52.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.739 -177.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.63 -44.17 3.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.665 -171.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.41 ' HB3' ' CE ' ' A' ' 22' ' ' MET . 0.0 OUTLIER -65.26 -23.72 67.12 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.642 -0.328 . . . . 0.0 111.516 -174.858 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -54.24 14.81 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.131 0.491 . . . . 0.0 111.252 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.624 ' HB2' HD13 ' A' ' 110' ' ' ILE . 57.0 mt -56.27 -38.17 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.198 -172.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.05 -31.21 70.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.121 -179.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.86 -8.65 58.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.851 0.357 . . . . 0.0 110.938 176.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.594 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 16.7 m-30 -92.77 -38.28 11.88 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.09 50.94 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.476 -0.868 . . . . 0.0 112.583 174.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.426 ' CE1' HD22 ' A' ' 102' ' ' LEU . 2.2 m-85 -92.92 159.73 15.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.617 0.246 . . . . 0.0 110.623 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -69.02 0.39 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.466 -177.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.05 117.4 12.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.981 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.624 HD13 ' HB2' ' A' ' 102' ' ' LEU . 1.0 OUTLIER -119.16 128.84 75.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.217 0.532 . . . . 0.0 110.948 -179.578 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -119.27 152.28 36.96 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.544 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -121.98 148.48 44.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.453 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 5.8 m -89.11 113.47 24.63 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -174.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.649 ' HG2' ' HB3' ' A' ' 24' ' ' MET . 1.0 OUTLIER -64.45 143.45 57.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.623 177.646 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 96.0 -104.93 3.17 Favored Glycine 0 N--CA 1.443 -0.854 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 171.11 -165.07 38.19 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' MET . . . . . 0.577 ' HA ' ' CZ ' ' A' ' 88' ' ' PHE . 9.5 tpt -65.41 -29.48 70.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.036 178.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -61.71 -28.77 69.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.002 178.457 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.741 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -73.56 -33.01 64.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 111.447 0.165 . . . . 0.0 111.447 -178.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.854 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 18.8 t-105 -61.33 -54.54 42.59 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.828 0.347 . . . . 0.0 110.069 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 121' ' ' LEU . 7.2 mt -62.89 -41.88 99.58 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.892 178.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.587 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.5 OUTLIER -65.33 -40.52 93.8 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.159 -177.007 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.601 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.7 tp10 -73.18 -4.89 35.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.918 0.39 . . . . 0.0 111.159 -177.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.49 27.33 63.63 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.771 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.601 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 97.1 mt -79.76 157.67 74.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 -178.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.405 ' HB2' ' O ' ' A' ' 58' ' ' ASP . 20.6 Cg_endo -57.09 120.36 8.23 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 123.299 2.666 . . . . 0.0 112.209 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.47 151.77 50.6 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.483 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.406 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 0.8 OUTLIER -100.52 107.87 19.67 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 176.506 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.53 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.385 -175.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.23 0 CA-C-O 120.628 0.252 . . . . 0.0 111.107 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' GLY . . . . . 0.76 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.67 -32.86 70.31 Favored Glycine 0 C--O 1.223 -0.541 0 CA-C-N 116.055 -0.52 . . . . 0.0 112.195 178.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.12 -31.61 62.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.059 0.457 . . . . 0.0 110.599 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -69.35 -57.19 5.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.076 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.76 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 3.8 p90 -72.56 -26.64 61.81 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.039 -0.664 . . . . 0.0 111.089 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . 0.562 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 0.3 OUTLIER -53.59 -42.78 67.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.556 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.07 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.995 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.82 -45.06 83.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.706 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' PHE . . . . . 0.594 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 0.1 OUTLIER -55.9 -46.94 78.23 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.307 0.575 . . . . 0.0 110.345 177.168 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' LYS . . . . . 0.642 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.24 -27.5 69.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.397 178.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.03 58.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.177 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -70.96 -50.61 32.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.465 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.477 HG21 ' HG2' ' A' ' 71' ' ' GLU . 0.9 OUTLIER -63.46 -33.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.949 -178.442 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.642 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -59.9 -39.36 85.09 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.573 0.225 . . . . 0.0 111.551 178.412 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.78 -26.39 68.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.977 0.418 . . . . 0.0 111.205 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.54 65.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.492 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -24.94 42.41 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.164 0.507 . . . . 0.0 111.128 173.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.61 -15.75 41.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.166 -173.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.98 -23.27 62.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -171.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' MET . . . . . 0.409 ' SD ' ' HB2' ' B' ' 112' ' ' ASN . 1.5 ptp -139.7 172.87 12.16 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.811 -177.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 22.9 t -67.27 109.55 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.553 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -83.43 121.16 26.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.251 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . 0.484 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.5 mt -129.5 141.63 50.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.9 -177.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.52 145.7 82.65 Favored Pre-proline 0 C--N 1.315 -0.934 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.552 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 1.3 Cg_endo -45.22 -29.74 4.57 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.01 3.14 . . . . 0.0 114.415 -175.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -44.84 49.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 111.143 177.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -29.9 68.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.472 178.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' B' ' 86' ' ' VAL . . . -74.35 -42.31 59.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.651 177.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' TYR . . . . . 0.507 ' CZ ' ' HG3' ' B' ' 126' ' ' PRO . 38.8 t80 -64.25 -40.59 96.33 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.036 0.446 . . . . 0.0 110.806 178.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 36' ' ' GLU . 0.1 OUTLIER -50.3 -53.76 26.26 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.262 -177.421 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.597 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.3 OUTLIER -74.94 -27.57 60.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.268 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' B' ' 42' ' ' LEU . 3.2 mt -63.85 -57.52 9.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.146 0.498 . . . . 0.0 112.027 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.28 -18.28 55.49 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.047 -172.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 32' ' ' LYS . 0.4 OUTLIER -98.2 -9.09 26.21 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.588 -176.537 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -133.76 106.74 11.72 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.818 0.342 . . . . 0.0 110.298 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . 0.446 ' HA ' HD21 ' B' ' 61' ' ' ASN . 27.6 Cg_exo -65.5 -2.73 6.57 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.23 2.62 . . . . 0.0 113.696 -176.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.54 -25.91 18.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.431 . . . . 0.0 110.115 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.597 HD12 ' HB2' ' B' ' 33' ' ' LEU . 9.1 mt -82.62 108.09 15.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.412 178.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.664 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -101.57 144.83 29.84 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.093 -177.681 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.93 HD11 ' HB2' ' B' ' 88' ' ' PHE . 0.9 OUTLIER -103.96 127.96 51.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 2.0 mp -108.82 119.58 58.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 175.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.875 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -110.08 136.12 49.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.701 -178.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -124.09 100.05 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.88 178.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -153.88 152.93 31.2 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.964 -174.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -69.68 135.13 88.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.771 0.319 . . . . 0.0 110.566 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.01 -19.22 68.6 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.084 2.523 . . . . 0.0 113.851 -175.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.32 -40.08 37.75 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.825 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -67.57 -35.21 78.58 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.833 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.7 OUTLIER -60.27 -34.76 74.17 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.66 174.296 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -71.97 -41.74 67.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.834 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.99 -47.77 14.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.151 -172.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 12.4 mtt -102.36 -34.31 9.23 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.607 -173.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.94 178.28 15.45 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.821 176.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' LYS . . . . . 0.833 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 6.6 pttt -135.18 155.3 79.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.86 127.44 25.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.892 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . 0.671 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 26.5 t0 -101.99 81.68 2.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.272 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.788 HG22 ' HB2' ' B' ' 62' ' ' TYR . 0.9 OUTLIER -120.13 157.48 22.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.194 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -51.96 63.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.643 -175.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.452 ' HB2' ' HA ' ' B' ' 41' ' ' THR . 0.2 OUTLIER -109.82 80.65 1.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 0.0 110.545 -179.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' TYR . . . . . 0.875 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.5 t80 -121.32 130.56 53.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.046 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.664 ' HE2' HG21 ' B' ' 41' ' ' THR . 3.9 mttm -129.59 121.86 27.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.364 177.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -84.92 111.18 19.44 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' MET . . . . . 0.624 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--N 1.324 -0.505 0 CA-C-O 120.729 0.299 . . . . 0.0 110.289 -177.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.59 HD11 HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.611 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -44.82 -58.23 5.74 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -172.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.611 ' HD3' ' CD ' ' B' ' 71' ' ' GLU . 6.8 Cg_exo -73.52 -16.13 24.38 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.507 2.138 . . . . 0.0 112.818 -179.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.624 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -87.87 -19.68 27.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.458 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.651 HD21 HD21 ' B' ' 102' ' ' LEU . 24.2 tp -60.6 -51.42 69.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.701 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.602 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -63.85 -24.0 67.57 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.0 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.76 -22.05 50.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -177.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' SER . . . . . 0.574 ' HB2' ' HG ' ' B' ' 79' ' ' LEU . 0.3 OUTLIER -75.17 -39.65 60.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.803 0.335 . . . . 0.0 110.556 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.71 39.32 6.26 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.925 -177.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.574 ' HG ' ' HB2' ' B' ' 77' ' ' SER . 7.3 mt -83.2 151.75 25.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.602 0.239 . . . . 0.0 110.558 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.475 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.6 OUTLIER -125.48 133.72 25.13 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 37.4 Cg_exo -64.84 4.38 0.67 Allowed 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 123.502 2.801 . . . . 0.0 113.822 -176.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.37 -2.02 24.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.836 0.35 . . . . 0.0 110.799 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -109.74 146.03 33.21 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.94 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.576 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 7.9 Cg_exo -75.08 143.57 28.96 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 111.832 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.4 OUTLIER -143.74 147.43 19.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.759 -178.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.412 HG21 ' HB1' ' B' ' 30' ' ' ALA . 2.3 p -124.78 139.63 50.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . 0.572 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 4.4 m -109.28 124.31 65.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.094 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' PHE . . . . . 0.93 ' HB2' HD11 ' B' ' 42' ' ' LEU . 9.6 t80 -104.4 136.62 43.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.148 -171.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' B' ' 117' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.67 0 O-C-N 124.291 0.995 . . . . 0.0 111.661 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . 0.572 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 120.765 0.317 . . . . 0.0 111.179 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 96' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 112' ' ' ASN . . . -54.77 -29.5 54.21 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.276 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 97' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' B' ' 97' ' ' LEU . 1.9 mm? -70.28 -32.04 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.888 0.375 . . . . 0.0 111.054 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.03 -44.26 55.0 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.01 0.433 . . . . 0.0 110.838 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -80.45 -48.3 6.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.629 -0.796 . . . . 0.0 113.444 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 100' ' ' LYS . . . . . 0.434 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -59.62 -42.74 93.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.809 0.337 . . . . 0.0 111.56 -172.748 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . 0.434 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 0.7 OUTLIER -69.71 -35.34 74.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.461 -178.094 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 102' ' ' LEU . . . . . 0.651 HD21 HD21 ' B' ' 74' ' ' LEU . 9.2 mt -62.56 -50.42 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.554 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 103' ' ' ARG . . . . . 0.575 ' HB3' HG21 ' B' ' 110' ' ' ILE . 0.9 OUTLIER -65.98 -30.69 71.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.887 0.375 . . . . 0.0 110.597 -179.891 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' B' ' 103' ' ' ARG . 7.2 mt-10 -71.24 -7.07 44.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.335 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -108.46 -11.51 15.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.746 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 129.74 14.73 2.05 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.017 -1.087 . . . . 0.0 113.89 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 107' ' ' PHE . . . . . 0.57 ' CE1' HD22 ' B' ' 102' ' ' LEU . 4.9 m-85 -70.97 140.23 50.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.399 0.599 . . . . 0.0 110.595 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.43 -81.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.784 -172.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -111.47 103.04 11.36 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.817 -176.213 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 110' ' ' ILE . . . . . 0.575 HG21 ' HB3' ' B' ' 103' ' ' ARG . 1.3 tt -114.47 131.1 67.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.472 0.653 . . . . 0.0 110.889 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -120.28 151.5 39.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.295 -178.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.587 HD21 ' HA ' ' B' ' 96' ' ' ALA . 4.6 t-20 -123.1 148.86 45.2 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.594 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 4.8 m -83.54 138.4 33.42 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.443 -177.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -97.39 152.99 18.38 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.117 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.98 -87.93 1.32 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.793 -176.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 150.31 -166.81 30.13 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.033 178.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 117' ' ' MET . . . . . 0.504 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 7.7 tmm? -67.96 -33.01 73.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.991 0.424 . . . . 0.0 110.66 179.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -63.87 -29.63 70.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.634 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 119' ' ' LYS . . . . . 0.552 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -69.14 -33.56 73.63 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.868 -0.151 . . . . 0.0 111.368 177.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 120' ' ' TRP . . . . . 0.847 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 34.8 t-105 -60.86 -53.56 55.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 121' ' ' LEU . 9.5 mt -64.94 -39.73 93.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 178.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.569 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.3 OUTLIER -63.94 -34.62 78.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.716 -176.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . 0.553 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.7 OUTLIER -82.49 -0.85 48.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.939 0.399 . . . . 0.0 111.095 -178.576 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.26 29.38 68.55 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.143 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.553 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 77.6 mt -79.68 160.77 68.8 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.604 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 21.9 Cg_endo -57.42 121.9 10.84 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 123.042 2.495 . . . . 0.0 112.152 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.56 151.14 52.02 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.436 -178.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 128' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.1 mt . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.428 ' HG3' ' HB2' ' A' ' 6' ' ' LYS . 2.8 tpp . . . . . 0 C--O 1.232 0.172 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.588 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -55.99 -32.03 59.14 Favored Glycine 0 C--O 1.229 -0.192 0 CA-C-N 116.205 -0.452 . . . . 0.0 112.943 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.19 -33.08 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.75 0.31 . . . . 0.0 111.095 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.428 ' HB2' ' HG3' ' A' ' 3' ' ' MET . 20.1 mmtt -68.9 -58.04 4.69 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -172.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.588 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.6 OUTLIER -72.29 -34.05 67.89 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.468 -173.496 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.72 -57.35 11.17 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 123.309 0.381 . . . . 0.0 110.931 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.66 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m -67.15 -44.94 78.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.255 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 7' ' ' PHE . 0.3 OUTLIER -54.16 -42.96 70.2 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.32 0.581 . . . . 0.0 109.908 178.485 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -65.94 -26.24 67.49 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.904 177.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.85 -45.66 49.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.852 0.358 . . . . 0.0 110.914 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -71.77 -50.47 29.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.96 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.746 HG11 ' HG2' ' B' ' 71' ' ' GLU . 0.8 OUTLIER -68.38 -34.19 64.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.464 -172.628 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.539 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -66.53 -27.74 68.0 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.222 -0.299 . . . . 0.0 111.157 -177.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.73 66.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.005 0.431 . . . . 0.0 111.187 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.24 70.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.023 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -23.94 49.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.313 0.578 . . . . 0.0 110.93 175.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.77 -20.68 27.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.977 -176.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -32.86 73.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.46 ' HG3' ' HB2' ' A' ' 112' ' ' ASN . 6.6 ptm -125.7 178.73 5.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.98 0.419 . . . . 0.0 111.924 -175.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.0 t -74.58 111.44 10.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.098 -178.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 2.0 mmt -79.89 105.41 11.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.861 -178.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.442 ' HB2' ' HB3' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -113.11 139.63 48.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.096 0.474 . . . . 0.0 110.583 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.7 143.29 67.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.796 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -51.29 -24.33 15.4 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.632 2.888 . . . . 0.0 113.951 -176.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 mtmt -74.29 -43.87 55.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.071 0.462 . . . . 0.0 110.909 177.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.45 -29.13 62.35 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.566 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.61 -45.34 62.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.634 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.558 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 74.5 t80 -67.23 -32.02 72.78 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.997 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.8 tptt -56.29 -50.17 72.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.146 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.51 ' O ' ' HB2' ' A' ' 37' ' ' ASN . 0.3 OUTLIER -74.23 -27.53 60.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.678 177.648 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.641 HD11 ' HB2' ' A' ' 42' ' ' LEU . 2.5 mt -64.23 -48.27 76.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.027 0.441 . . . . 0.0 111.379 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -21.93 57.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.416 -175.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.98 -27.89 15.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 111.232 -177.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 5.9 m-80 -112.24 108.91 54.58 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.515 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -71.39 0.57 6.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 122.779 2.319 . . . . 0.0 112.037 177.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.72 -26.44 13.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.586 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.837 HG12 ' HG2' ' A' ' 84' ' ' PRO . 36.7 mt -80.66 113.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.73 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.79 144.06 31.98 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 -177.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.997 HD11 ' HB2' ' A' ' 88' ' ' PHE . 27.2 tp -96.56 121.41 38.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 88.2 mt -103.18 111.11 31.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.777 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -104.73 140.85 37.47 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . 0.408 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -124.18 98.22 5.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.489 177.549 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.552 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -144.19 149.17 35.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.404 179.249 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.552 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 4.5 m-20 -67.67 141.17 94.88 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.039 -175.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -58.13 -25.75 72.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.546 2.831 . . . . 0.0 114.464 -169.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.21 -43.48 57.01 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.974 -0.69 . . . . 0.0 111.955 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 46' ' ' ARG . 27.2 tt0 -65.1 -35.37 80.9 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.857 176.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.659 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -57.38 -35.42 69.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.72 176.353 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.5 mtpt -79.61 -43.54 22.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.253 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -91.12 -48.07 7.17 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 mtm -95.56 -35.1 11.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.339 -174.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.69 171.03 12.9 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 113.641 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.659 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -142.49 162.35 45.12 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -62.83 132.44 37.3 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 121.934 1.756 . . . . 0.0 112.679 -176.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' A' ' 126' ' ' PRO . 20.0 t0 -107.37 77.41 1.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.068 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.448 HG22 ' HB2' ' A' ' 62' ' ' TYR . 3.0 m -119.3 166.78 13.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.6 -41.16 93.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.982 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 86.0 2.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.033 0.444 . . . . 0.0 111.036 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.777 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.0 OUTLIER -128.98 132.81 47.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.56 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.95 119.78 32.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.473 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -86.68 118.73 26.28 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 175.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.738 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.637 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.264 -174.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.738 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.894 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.795 ' HG2' HG11 ' B' ' 15' ' ' VAL . 0.2 OUTLIER -44.05 -61.82 1.82 Allowed Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -172.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.606 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 7.6 Cg_exo -73.86 -15.85 23.59 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.448 2.098 . . . . 0.0 113.146 -178.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.6 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.1 OUTLIER -90.01 -19.08 24.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.908 0.385 . . . . 0.0 110.874 -177.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.495 ' CD1' HD21 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -73.14 -28.94 62.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.385 0.612 . . . . 0.0 110.43 -179.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.56 -28.28 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.958 173.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -18.06 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.943 -177.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -41.3 27.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.969 0.414 . . . . 0.0 110.281 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.85 55.34 1.15 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.395 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.9 mt -94.32 145.22 24.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.665 0.269 . . . . 0.0 110.493 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -127.1 158.1 70.08 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.546 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 45.5 Cg_endo -70.93 9.16 0.84 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.89 2.393 . . . . 0.0 114.158 -174.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.406 ' H ' ' HG3' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -118.06 -1.9 11.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.824 0.345 . . . . 0.0 110.585 179.062 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.3 mmtm -88.53 134.6 33.89 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.29 -176.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.837 ' HG2' HG12 ' A' ' 40' ' ' ILE . 27.9 Cg_endo -88.29 124.31 1.7 Allowed 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.05 2.5 . . . . 0.0 111.261 175.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.508 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -135.35 149.92 28.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 111.205 -176.079 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -124.29 141.2 45.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.916 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 8.0 m -106.91 133.53 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.997 ' HB2' HD11 ' A' ' 42' ' ' LEU . 14.4 t80 -116.97 137.2 52.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.935 -171.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 117' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.472 0.672 0 O-C-N 124.407 1.067 . . . . 0.0 112.034 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.916 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 C--O 1.229 -0.022 0 CA-C-O 120.907 0.384 . . . . 0.0 111.242 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.453 ' HA ' ' ND2' ' A' ' 112' ' ' ASN . . . -58.64 -34.94 71.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.194 179.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -67.11 -30.41 70.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.866 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.52 -40.6 49.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.791 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -96.86 -40.8 3.72 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.852 -171.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -25.02 67.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.847 0.356 . . . . 0.0 111.24 -174.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.59 -49.67 38.19 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.842 177.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.495 HD21 ' CD1' ' A' ' 74' ' ' LEU . 22.8 mt -57.79 -42.21 83.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.682 -174.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.412 ' HD3' ' HB3' ' A' ' 22' ' ' MET . 0.0 OUTLIER -68.68 -26.62 65.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.84 0.352 . . . . 0.0 110.742 178.314 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.71 -8.39 57.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.226 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.477 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 14.2 m-85 -105.26 -42.05 5.37 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 176.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 142.53 85.32 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.349 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.453 ' CE1' HD22 ' A' ' 102' ' ' LEU . 1.5 m-85 -126.44 156.75 40.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.605 0.24 . . . . 0.0 110.601 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -71.29 0.24 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.354 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.45 111.94 9.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.05 -177.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.508 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 1.5 tt -122.92 128.94 75.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.304 0.573 . . . . 0.0 111.062 -178.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.442 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 0.9 OUTLIER -117.52 149.84 39.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.501 -177.206 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.46 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 8.1 t-20 -118.63 144.77 45.93 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.454 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 92.0 p -81.56 135.57 35.58 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.137 0.494 . . . . 0.0 111.95 -171.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.49 136.74 33.3 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.617 169.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 87.07 -127.13 8.28 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.271 -172.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -178.75 -159.96 23.98 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' MET . . . . . 0.464 ' HB2' ' SG ' ' A' ' 89' ' ' CYS . 0.0 OUTLIER -58.78 -33.79 70.71 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.401 . . . . 0.0 110.712 178.663 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . 0.478 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.25 -34.37 72.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.962 178.465 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.451 ' HD2' ' OD1' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -73.93 -32.14 63.38 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.488 0.185 . . . . 0.0 111.174 -179.385 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.749 ' HB2' ' HZ ' ' A' ' 88' ' ' PHE . 18.6 t-105 -62.39 -54.28 42.58 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.474 ' HA ' HD23 ' A' ' 121' ' ' LEU . 2.2 mt -63.77 -42.4 97.78 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.7 0.286 . . . . 0.0 111.045 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 2.1 tt0 -62.1 -40.98 97.69 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.793 -177.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.545 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.8 OUTLIER -77.78 -0.72 28.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 69.12 29.67 72.14 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.925 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.545 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 75.2 mt -77.4 158.42 79.15 Favored Pre-proline 0 N--CA 1.45 -0.472 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.545 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 19.7 Cg_endo -55.31 114.41 1.86 Allowed 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 123.262 2.642 . . . . 0.0 112.129 -179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.78 152.9 51.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.073 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.0 mt -102.96 100.5 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.317 -0.815 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.775 -178.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' MET . . . . . 0.546 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mpp? . . . . . 0 N--CA 1.453 -0.292 0 CA-C-O 120.647 0.261 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' GLY . . . . . 0.585 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.85 -33.7 69.11 Favored Glycine 0 C--O 1.226 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.52 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -31.25 62.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.864 0.364 . . . . 0.0 111.143 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.461 ' HG3' ' HA ' ' B' ' 3' ' ' MET . 4.8 mmtt -72.29 -58.06 3.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.269 -172.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.585 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.1 p90 -73.69 -27.09 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.26 -175.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -47.12 69.38 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.425 0.453 . . . . 0.0 110.425 -177.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.9 -43.55 86.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.322 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -42.97 77.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.75 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' PHE . . . . . 0.477 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 1.0 OUTLIER -55.33 -48.76 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.307 0.575 . . . . 0.0 110.398 178.101 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' LYS . . . . . 0.646 ' HE2' ' HB2' ' A' ' 71' ' ' GLU . 1.8 tppt? -65.8 -26.05 67.52 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.94 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.19 -41.63 63.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.143 0.497 . . . . 0.0 111.061 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.55 -49.14 43.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.272 177.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.795 HG11 ' HG2' ' A' ' 71' ' ' GLU . 1.2 t -64.45 -34.35 68.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.03 -174.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.584 ' HD2' ' HG3' ' B' ' 12' ' ' LYS . 0.2 OUTLIER -68.35 -38.9 81.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.692 0.282 . . . . 0.0 111.187 -178.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.27 -32.32 68.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.806 -177.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.81 73.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.141 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.43 -23.77 42.94 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.456 0.646 . . . . 0.0 110.803 173.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.67 -14.01 46.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.957 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -73.99 -20.39 60.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.115 -174.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' MET . . . . . 0.593 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 3.4 ptm -122.45 177.77 5.26 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.91 0.386 . . . . 0.0 111.503 -178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.9 t -74.49 110.62 9.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.595 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.03 109.08 14.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.688 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' B' ' 25' ' ' LEU . 2.7 mt -112.16 -168.76 1.36 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.052 0.453 . . . . 0.0 110.513 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 1.1 p -129.82 144.61 53.7 Favored Pre-proline 0 C--N 1.321 -0.67 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.424 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 7.9 Cg_endo -52.76 -17.18 6.82 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 123.34 2.693 . . . . 0.0 113.817 -176.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -73.05 -47.08 47.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.946 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.47 -33.22 42.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.725 178.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.537 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -64.21 -47.02 81.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.579 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' TYR . . . . . 0.672 ' HA ' HD12 ' B' ' 34' ' ' LEU . 39.0 t80 -66.92 -30.95 71.23 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.714 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -47.15 87.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.666 0.27 . . . . 0.0 111.32 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.608 HD13 HG21 ' B' ' 40' ' ' ILE . 0.3 OUTLIER -70.03 -26.57 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.088 -0.245 . . . . 0.0 110.991 178.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.672 HD12 ' HA ' ' B' ' 31' ' ' TYR . 51.7 mt -72.43 -45.36 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 110.705 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -73.59 -24.12 60.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.094 -174.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -105.13 -9.59 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . 0.555 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 42.7 m-20 -129.47 111.18 17.8 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.731 0.3 . . . . 0.0 110.525 178.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -71.9 -1.63 10.25 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.155 2.57 . . . . 0.0 112.801 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -105.78 -26.31 11.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.542 -177.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.608 HG21 HD13 ' B' ' 33' ' ' LEU . 36.1 mt -77.53 110.58 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 175.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -100.64 144.67 29.34 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.791 -173.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.841 HD11 ' HB2' ' B' ' 88' ' ' PHE . 3.1 tp -104.85 125.31 50.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.3 mp -104.34 114.05 42.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 175.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.827 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -102.8 133.9 47.08 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.446 -178.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . 0.493 ' O ' ' HG2' ' B' ' 46' ' ' ARG . 0.1 OUTLIER -122.13 97.86 5.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.547 -178.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . 0.493 ' HG2' ' O ' ' B' ' 45' ' ' VAL . 0.0 OUTLIER -149.21 164.35 35.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.731 -178.54 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -71.55 137.01 83.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.668 0.271 . . . . 0.0 110.961 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.04 -26.68 58.02 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.688 2.258 . . . . 0.0 113.54 -177.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . 0.653 ' HA ' ' HD3' ' B' ' 52' ' ' LYS . 4.2 t0 -78.39 -33.25 48.94 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.233 176.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' GLU . . . . . 0.482 ' CD ' HH21 ' B' ' 46' ' ' ARG . 3.5 mt-10 -65.14 -34.76 79.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.073 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.872 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 mp -65.42 -35.12 79.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.432 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' LYS . . . . . 0.653 ' HD3' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -69.62 -39.97 76.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.436 178.324 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.11 -48.31 13.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 112.609 -173.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -97.52 -35.01 10.78 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.492 -172.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.12 172.72 14.93 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.91 -0.662 . . . . 0.0 111.794 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' LYS . . . . . 0.872 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 11.9 pttt -140.47 155.31 69.91 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . 0.407 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 11.8 Cg_endo -59.02 124.26 15.29 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.51 2.14 . . . . 0.0 112.684 -177.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . 0.711 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 33.8 t0 -97.25 73.76 2.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.344 0.592 . . . . 0.0 110.486 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.624 HG22 ' HB2' ' B' ' 62' ' ' TYR . 2.8 m -113.31 171.26 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -30.07 55.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.979 0.419 . . . . 0.0 111.364 -174.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -122.55 65.23 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.649 -177.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' TYR . . . . . 0.827 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 1.2 t80 -114.85 125.29 53.5 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.477 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.424 ' HB3' ' HE1' ' B' ' 65' ' ' MET . 2.1 mttt -123.55 119.59 30.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -80.93 115.48 20.42 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' MET . . . . . 0.773 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.579 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.704 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.746 ' HG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -45.39 -60.71 2.98 Favored Pre-proline 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.16 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 11.8 Cg_exo -73.24 -16.09 25.16 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.576 2.184 . . . . 0.0 113.225 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.773 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -85.53 -15.79 41.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.142 -175.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.949 HD21 HD21 ' B' ' 102' ' ' LEU . 9.5 tp -58.56 -49.19 78.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.262 0.553 . . . . 0.0 110.807 -179.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.32 -26.57 66.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.333 -179.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -74.43 -29.59 61.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.009 -175.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.54 -34.51 67.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 111.096 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.91 50.47 2.86 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.59 -0.815 . . . . 0.0 111.284 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 20.0 mt -97.23 148.42 23.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.778 0.323 . . . . 0.0 110.614 -178.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.462 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.5 OUTLIER -136.38 137.54 24.57 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.538 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 30.1 Cg_exo -67.23 24.17 0.11 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.416 2.744 . . . . 0.0 114.222 -174.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.6 4.01 23.52 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.33 0.586 . . . . 0.0 109.793 174.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' LYS . . . . . 0.453 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.2 mttp -119.17 132.86 23.8 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.16 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' B' ' 83' ' ' LYS . 6.1 Cg_exo -69.62 143.01 50.15 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.453 2.102 . . . . 0.0 110.865 174.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.557 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 2.1 m -141.47 151.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -176.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.481 HG23 ' HB2' ' B' ' 111' ' ' TYR . 2.8 p -127.46 142.79 42.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 175.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . 0.806 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 18.6 m -104.93 157.9 5.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' PHE . . . . . 0.841 ' HB2' HD11 ' B' ' 42' ' ' LEU . 4.4 t80 -122.99 111.4 16.56 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 125.171 1.389 . . . . 0.0 112.781 176.252 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . 0.806 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . . . . . . 0 C--O 1.226 -0.163 0 CA-C-O 120.94 0.4 . . . . 0.0 110.807 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.16 67.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 178.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 97' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' B' ' 97' ' ' LEU . 2.1 mm? -76.27 -28.07 56.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.271 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 98' ' ' ALA . . . . . 0.611 ' HA ' HD21 ' B' ' 70' ' ' LEU . . . -72.44 -30.94 65.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.321 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 99' ' ' GLY . . . . . 0.449 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -103.76 -46.22 1.42 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.727 -174.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 100' ' ' LYS . . . . . 0.429 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -62.46 -33.12 74.2 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.571 -0.37 . . . . 0.0 111.142 -174.832 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . 0.429 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 1.2 m -73.46 -36.29 65.83 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.941 0.4 . . . . 0.0 111.061 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 102' ' ' LEU . . . . . 0.949 HD21 HD21 ' B' ' 74' ' ' LEU . 5.6 mt -67.78 -38.53 83.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.258 -176.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -26.13 67.25 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.917 0.389 . . . . 0.0 110.612 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.43 -5.58 50.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.273 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . 0.417 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 22.0 m-30 -105.8 -8.14 17.93 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.078 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 123.73 5.05 7.81 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.012 -1.09 . . . . 0.0 113.734 171.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 107' ' ' PHE . . . . . 0.418 ' CE1' HD22 ' B' ' 102' ' ' LEU . 8.7 m-85 -69.4 130.54 42.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 117.034 0.417 . . . . 0.0 110.589 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -57.58 -80.76 0.02 OUTLIER 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.087 -172.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.06 115.7 26.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.968 -177.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 110' ' ' ILE . . . . . 0.557 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.4 tt -118.92 127.37 75.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.604 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 111' ' ' TYR . . . . . 0.481 ' HB2' HG23 ' B' ' 86' ' ' VAL . 4.7 m-85 -113.39 144.5 42.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.387 -175.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.593 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 17.9 t-20 -117.62 143.41 46.16 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.146 -0.686 . . . . 0.0 109.146 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.611 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -83.06 134.32 35.03 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.633 -175.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.69 153.91 20.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.826 -1.079 . . . . 0.0 108.373 164.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . 0.597 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 82.9 -108.44 2.98 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 -173.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.15 -156.14 27.35 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.75 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 1.6 ttt -61.43 -35.21 76.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.961 0.41 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.8 -38.57 75.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.639 177.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 119' ' ' LYS . . . . . 0.597 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -66.46 -33.21 75.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.805 -179.495 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 120' ' ' TRP . . . . . 0.679 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 30.7 t-105 -59.99 -53.62 55.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' B' ' 121' ' ' LEU . 12.8 mt -64.31 -39.69 94.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.861 177.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -61.59 -40.64 95.5 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.957 0.408 . . . . 0.0 111.369 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -74.05 -12.49 60.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.802 -179.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.2 56.98 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.572 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.45 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 83.7 mt -80.34 159.3 70.35 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.273 . . . . 0.0 110.607 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 14.3 Cg_endo -54.57 119.36 6.29 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 123.09 2.526 . . . . 0.0 112.163 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.48 152.75 51.42 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.316 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 128' ' ' LEU . . . . . 0.711 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 3.2 mt . . . . . 0 C--N 1.32 -0.703 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.203 0 N-CA-C 111.563 0.208 . . . . 0.0 111.563 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.603 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -63.61 -52.27 47.4 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.041 178.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -59.75 -32.46 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.528 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -66.42 -57.51 7.24 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.055 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.603 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.3 OUTLIER -84.28 -22.7 30.64 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -175.624 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.627 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 17.5 t70 -54.27 -41.94 69.41 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 111.023 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.83 -37.7 67.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.137 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -43.11 82.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.475 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.412 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.8 OUTLIER -58.18 -41.68 84.43 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.093 -179.309 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.594 ' HE2' ' HG3' ' B' ' 72' ' ' PRO . 12.2 tptp -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.164 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.97 -46.34 30.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.492 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -70.59 -51.86 25.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.798 -176.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.47 -34.32 50.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.898 0.38 . . . . 0.0 110.865 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.5 tptm -62.08 -36.08 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.395 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.62 -26.01 68.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.281 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.83 -31.91 71.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.656 176.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 7.2 mtpp -75.86 -21.06 57.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.46 0.648 . . . . 0.0 110.819 173.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.46 46.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.279 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -75.64 -15.28 60.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.889 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.686 ' HG3' HG23 ' A' ' 110' ' ' ILE . 1.5 mpp? -121.58 -179.45 4.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.965 0.412 . . . . 0.0 111.237 -177.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.5 t -88.22 105.81 15.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.61 175.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.801 ' HG3' ' HG2' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -73.45 100.04 3.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.856 0.36 . . . . 0.0 110.29 -177.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.493 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -116.27 142.51 46.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.193 0.52 . . . . 0.0 111.127 -175.743 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.18 138.41 48.96 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.853 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.58 ' HA ' ' HB3' ' A' ' 30' ' ' ALA . 10.1 Cg_endo -52.65 -14.46 3.28 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.697 2.932 . . . . 0.0 114.308 -176.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.42 -45.78 52.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.836 0.351 . . . . 0.0 110.795 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.0 OUTLIER -79.6 -33.34 41.64 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.544 176.175 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.58 ' HB3' ' HA ' ' A' ' 27' ' ' PRO . . . -62.43 -39.52 93.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.453 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.498 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 63.5 t80 -74.19 -32.56 63.12 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -51.55 67.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.683 ' HB2' HD12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -73.85 -27.54 61.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.72 0.295 . . . . 0.0 110.864 178.509 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.855 HD11 ' HB2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.55 -50.59 72.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.207 0.527 . . . . 0.0 110.838 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -27.5 56.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -76.75 -31.9 57.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.77 0.319 . . . . 0.0 111.067 -177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . 0.76 ' HB2' HG13 ' A' ' 40' ' ' ILE . 44.6 m-20 -119.73 114.42 34.15 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.842 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 15.6 Cg_exo -68.74 -0.27 5.86 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.197 2.598 . . . . 0.0 112.925 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -105.36 -18.48 14.1 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.193 179.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.82 HG12 ' HG2' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -74.27 114.37 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.615 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.529 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -107.64 140.04 41.26 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.793 -177.085 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.855 ' HB2' HD11 ' A' ' 34' ' ' LEU . 10.7 tp -103.93 120.92 42.04 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.562 HD11 HD21 ' A' ' 79' ' ' LEU . 1.3 mp -104.35 113.74 42.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.639 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 2.2 t70 -102.47 140.25 37.0 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.725 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -122.75 93.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.622 0.725 . . . . 0.0 109.777 173.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.417 HH12 ' CD ' ' A' ' 50' ' ' GLU . 11.9 mmm180 -143.27 152.64 41.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.415 178.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.94 142.07 64.29 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.498 -173.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -59.86 -25.28 78.92 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 123.37 2.714 . . . . 0.0 113.565 -172.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.81 -38.45 46.47 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.212 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.417 ' CD ' HH12 ' A' ' 46' ' ' ARG . 0.4 OUTLIER -72.91 -37.44 67.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 175.268 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.968 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.3 tp -59.35 -33.31 71.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.519 174.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -37.59 60.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.132 178.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.48 -49.66 13.02 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -174.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -100.11 -35.8 9.55 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.289 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.15 178.48 15.33 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.459 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.968 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -140.58 154.06 68.83 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.429 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.6 Cg_endo -61.38 123.27 12.46 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 121.976 1.784 . . . . 0.0 112.674 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 46.7 t0 -86.54 93.56 9.21 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 174.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 1.041 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -129.84 151.42 35.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.234 -177.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.87 76.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.172 0.51 . . . . 0.0 110.911 -178.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -116.95 66.84 0.72 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.356 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 1.041 ' HB2' HG23 ' A' ' 59' ' ' VAL . 12.2 t80 -108.38 122.52 47.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.611 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.529 ' HE2' HG21 ' A' ' 41' ' ' THR . 18.9 mttm -122.83 109.31 14.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -93.11 114.53 27.07 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . 0.547 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 CA-C-O 120.841 0.353 . . . . 0.0 110.326 179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.531 ' HG ' ' N ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.28 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.531 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -47.31 -53.89 25.49 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.369 -175.626 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.504 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 73.9 Cg_endo -73.76 -16.73 23.44 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.076 1.851 . . . . 0.0 112.983 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.547 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -88.44 -15.74 34.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.671 0.272 . . . . 0.0 111.021 -177.809 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.887 HD21 HD21 ' A' ' 102' ' ' LEU . 6.3 tp -58.42 -53.49 57.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.176 0.512 . . . . 0.0 111.024 -178.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.47 -27.06 62.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.317 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.6 -28.79 62.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.84 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.509 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 41.2 m -77.41 -38.08 50.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.14 0.495 . . . . 0.0 109.957 178.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.24 81.25 1.58 Allowed Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.269 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.562 HD21 HD11 ' A' ' 43' ' ' ILE . 29.1 mt -122.36 148.64 44.82 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.476 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -128.06 138.93 34.0 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -70.54 -0.82 8.14 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 122.919 2.413 . . . . 0.0 114.266 -170.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.563 ' HA ' ' HG3' ' A' ' 108' ' ' LYS . 38.3 mm-40 -100.03 9.34 43.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.133 0.492 . . . . 0.0 109.997 175.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.476 ' HG3' ' OD2' ' A' ' 80' ' ' ASP . 7.2 mttm -102.82 128.11 28.58 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.235 -178.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.82 ' HG2' HG12 ' A' ' 40' ' ' ILE . 72.9 Cg_endo -72.96 122.06 7.81 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.409 2.072 . . . . 0.0 110.806 174.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.474 HG12 ' HB ' ' A' ' 41' ' ' THR . 1.8 m -130.56 152.62 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.029 0.443 . . . . 0.0 111.371 -173.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.607 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 1.2 p -127.07 142.49 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 16.4 m -104.33 135.82 40.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.124 0.488 . . . . 0.0 110.556 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.823 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.9 t80 -119.48 144.65 46.88 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.753 -177.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' CYS . . . . . 0.626 ' HB3' ' HB2' ' A' ' 95' ' ' ALA . 52.7 t . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.446 179.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.626 ' HB2' ' HB3' ' A' ' 89' ' ' CYS . . . . . . . . 0 CA--C 1.527 0.065 0 CA-C-O 121.117 0.484 . . . . 0.0 110.627 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.71 -27.91 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.174 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.453 HD21 HD21 ' B' ' 97' ' ' LEU . 2.8 mm? -67.59 -35.27 78.67 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.407 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.73 -45.63 50.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.913 0.387 . . . . 0.0 110.427 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -70.21 -53.45 13.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.57 -177.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -62.3 -35.81 80.19 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.704 -0.292 . . . . 0.0 111.408 -174.245 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.504 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 23.4 m -70.75 -35.57 72.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.826 0.346 . . . . 0.0 110.8 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.887 HD21 HD21 ' A' ' 74' ' ' LEU . 13.1 mt -66.36 -47.77 72.35 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.84 0.352 . . . . 0.0 111.083 177.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.709 ' HB3' HG21 ' A' ' 110' ' ' ILE . 0.6 OUTLIER -67.79 -26.17 65.96 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.966 0.413 . . . . 0.0 110.356 178.535 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -8.08 32.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.395 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -108.81 -12.03 14.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.576 0.226 . . . . 0.0 111.385 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.58 18.5 4.83 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.072 -1.061 . . . . 0.0 113.343 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.443 ' CE1' HD22 ' A' ' 102' ' ' LEU . 4.2 m-85 -66.2 140.16 58.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.563 ' HG3' ' HA ' ' A' ' 82' ' ' GLU . 14.5 mtpp -62.69 -84.69 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.194 -171.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.39 109.85 19.36 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.686 -177.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.709 HG21 ' HB3' ' A' ' 103' ' ' ARG . 1.3 tt -114.71 128.74 71.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.154 0.502 . . . . 0.0 111.247 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.607 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 12.0 m-85 -113.36 139.67 48.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.433 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -115.98 144.41 44.11 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.05 130.12 34.87 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.867 -173.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.801 ' HG2' ' HG3' ' A' ' 24' ' ' MET . 0.0 OUTLIER -96.09 17.29 15.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.374 172.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.46 -70.63 0.12 Allowed Glycine 0 N--CA 1.442 -0.944 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.836 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 114.59 177.71 18.96 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.08 179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' MET . . . . . 0.552 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -57.73 -37.98 74.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.822 0.344 . . . . 0.0 111.11 -178.199 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.53 -28.52 70.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.505 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -75.38 -31.95 60.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.37 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.69 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -57.24 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 62.4 mt -63.21 -37.4 87.08 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.555 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -60.23 -40.09 89.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.718 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.504 ' HB2' ' HG ' ' A' ' 125' ' ' LEU . 38.6 mm-40 -81.89 -3.08 53.3 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.251 -177.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.98 32.46 73.33 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.575 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 76.6 mt -78.82 163.26 61.58 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.359 -178.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.575 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 28.2 Cg_endo -57.53 113.26 1.42 Allowed 'Trans proline' 0 CA--C 1.517 -0.338 0 C-N-CA 122.824 2.35 . . . . 0.0 111.484 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.9 m -121.09 151.07 40.28 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . 0.779 ' HB3' ' HE2' ' A' ' 56' ' ' LYS . 1.3 mt -98.92 101.35 12.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.838 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 . . . . . 0 C--N 1.316 -0.862 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.318 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 1.6 ttm . . . . . 0 N--CA 1.456 -0.155 0 CA-C-O 120.62 0.248 . . . . 0.0 111.316 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' GLY . . . . . 0.71 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -55.13 -34.96 59.02 Favored Glycine 0 C--O 1.227 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.427 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.58 -32.24 71.34 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 122.946 0.498 . . . . 0.0 111.628 176.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -72.79 -57.93 3.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.133 -174.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.71 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.3 p90 -74.75 -25.66 59.24 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.521 -176.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -53.71 -52.47 59.96 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 123.361 0.413 . . . . 0.0 110.553 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.81 -44.3 77.64 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.84 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -42.29 86.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -175.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' PHE . . . . . 0.403 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 0.6 OUTLIER -53.5 -43.81 68.54 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.221 0.534 . . . . 0.0 110.704 -178.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -24.58 65.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.258 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.66 -48.78 36.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.866 0.365 . . . . 0.0 110.81 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -67.69 -51.41 49.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.303 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.69 -34.1 41.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.935 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . 0.436 ' HB3' ' HE2' ' B' ' 16' ' ' LYS . 5.9 mtpt -66.63 -39.43 88.27 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.741 0.305 . . . . 0.0 111.16 176.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.93 -26.89 68.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.573 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.45 -33.3 64.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.116 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.658 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 0.1 OUTLIER -75.94 -21.25 57.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.125 0.488 . . . . 0.0 110.928 174.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.96 -19.16 61.94 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.026 -174.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.5 -1.18 57.62 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -176.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' MET . . . . . 0.856 ' HG3' HG23 ' B' ' 110' ' ' ILE . 1.5 mpp? -120.47 165.93 14.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.83 0.348 . . . . 0.0 111.343 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 15.4 t -80.99 103.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' MET . . . . . 0.658 ' SD ' ' HB3' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -79.14 107.21 11.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.997 0.427 . . . . 0.0 110.672 -174.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . 0.516 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.1 mt -126.73 142.08 51.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.662 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.48 151.8 85.33 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.203 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.428 ' HB2' ' CD1' ' B' ' 125' ' ' LEU . 4.7 Cg_endo -47.66 -31.33 14.14 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.854 3.036 . . . . 0.0 114.372 -177.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . 0.854 ' HD3' ' HG2' ' B' ' 123' ' ' GLU . 1.3 mtmm -74.43 -42.67 58.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.471 . . . . 0.0 110.791 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.94 -32.44 69.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.117 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.26 -44.05 69.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.464 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' TYR . . . . . 0.595 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.3 t80 -67.03 -30.47 70.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.204 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -57.09 -52.85 63.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.035 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.719 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -73.9 -27.75 61.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.677 178.321 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.695 HD11 ' HB2' ' B' ' 42' ' ' LEU . 1.1 mt -61.73 -55.8 26.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.945 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.06 -22.19 55.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.775 -173.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.84 -31.78 20.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.964 0.411 . . . . 0.0 110.555 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -121.3 102.94 42.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.437 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . 0.545 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 17.1 Cg_exo -68.27 5.81 1.08 Allowed 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.261 2.641 . . . . 0.0 112.545 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.83 -27.56 17.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.583 174.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.719 HD12 ' HB2' ' B' ' 33' ' ' LEU . 9.2 mt -82.37 109.2 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.688 175.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.417 HG21 ' HE2' ' B' ' 63' ' ' LYS . 1.2 m -100.25 145.22 28.35 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.672 -176.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.996 HD11 ' HB2' ' B' ' 88' ' ' PHE . 12.2 tp -101.1 122.58 43.84 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.479 HG23 ' HE3' ' B' ' 65' ' ' MET . 79.7 mt -103.85 111.16 32.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.213 176.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.833 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -98.96 129.43 45.27 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.68 96.64 4.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.366 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . 0.568 ' HG2' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -155.75 167.0 31.82 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.369 -177.464 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.47 ' H ' ' HD2' ' B' ' 46' ' ' ARG . 0.7 OUTLIER -75.6 125.66 88.31 Favored Pre-proline 0 C--N 1.314 -0.941 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.125 -176.439 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' B' ' 51' ' ' LEU . 18.4 Cg_endo -65.43 -19.79 61.22 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.901 2.401 . . . . 0.0 113.472 -172.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.66 -46.15 73.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.975 0.417 . . . . 0.0 110.472 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.05 -34.07 66.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.582 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.859 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.5 OUTLIER -58.87 -45.77 89.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.467 0.651 . . . . 0.0 110.253 176.597 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -66.53 -37.01 84.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.4 -48.41 10.38 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -174.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.1 -35.79 11.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.932 -172.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 135.64 159.36 8.53 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.125 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' LYS . . . . . 0.859 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -139.49 154.99 72.04 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.06 123.23 13.36 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.278 1.986 . . . . 0.0 112.562 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -101.83 74.99 1.51 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.2 0.524 . . . . 0.0 109.954 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.593 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.1 m -115.95 167.92 8.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.837 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -41.53 99.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.942 -175.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.545 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 0.0 OUTLIER -122.49 77.34 1.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.362 0.601 . . . . 0.0 110.857 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' TYR . . . . . 0.833 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.2 t80 -122.57 127.8 49.91 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.749 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.417 ' HE2' HG21 ' B' ' 41' ' ' THR . 11.2 mttt -123.29 124.57 43.27 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.876 176.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -88.11 128.34 35.42 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' MET . . . . . 0.479 ' HE3' HG23 ' B' ' 43' ' ' ILE . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.733 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 173.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.401 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.263 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.457 ' CB ' ' HD3' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -50.24 -59.47 7.06 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.399 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.594 ' HG3' ' HE2' ' A' ' 12' ' ' LYS . 3.9 Cg_exo -74.43 -15.85 22.04 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.605 2.203 . . . . 0.0 112.965 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' B' ' 73' ' ' LEU . 0.2 OUTLIER -87.19 -6.22 58.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.607 0.242 . . . . 0.0 111.504 -174.767 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.598 HD23 ' CD1' ' A' ' 7' ' ' PHE . 6.0 tp -63.98 -54.87 27.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.555 -175.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.627 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -69.73 -23.62 63.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.891 0.377 . . . . 0.0 111.399 -179.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.91 -31.21 61.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.796 -177.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -73.93 -39.26 63.92 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.13 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.55 81.2 1.46 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.908 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.5 mt -123.45 142.54 50.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.657 0.265 . . . . 0.0 110.93 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . 0.514 ' OD2' ' HG2' ' B' ' 83' ' ' LYS . 0.0 OUTLIER -114.77 136.28 22.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.24 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.49 -0.37 2.93 Favored 'Trans proline' 0 N--CA 1.476 0.468 0 C-N-CA 123.078 2.519 . . . . 0.0 114.234 -172.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.444 ' HB2' ' OD2' ' B' ' 80' ' ' ASP . 3.6 mm-40 -98.73 -11.59 21.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 0.0 110.717 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' LYS . . . . . 0.514 ' HG2' ' OD2' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -82.85 122.01 77.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.626 179.028 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.547 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 15.9 Cg_exo -63.94 132.7 35.6 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.363 2.042 . . . . 0.0 110.168 173.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.516 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.0 OUTLIER -131.58 143.01 41.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 120.893 0.378 . . . . 0.0 111.124 -173.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.538 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 0.7 OUTLIER -121.85 139.78 47.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 175.508 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' B' ' 43' ' ' ILE . 1.3 m -102.8 126.46 57.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.074 0.464 . . . . 0.0 110.33 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' PHE . . . . . 0.996 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.2 t80 -111.88 140.27 46.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.371 -174.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . 0.568 ' SG ' ' HG2' ' B' ' 46' ' ' ARG . 49.6 t . . . . . 0 N--CA 1.463 0.189 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.866 176.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.934 0.397 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.36 72.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.111 -176.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 97' ' ' LEU . . . . . 0.453 HD21 HD21 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -67.78 -39.59 84.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.799 0.333 . . . . 0.0 110.93 -178.461 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.99 -45.57 70.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.0 0.429 . . . . 0.0 110.237 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.21 -50.47 33.17 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.54 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 100' ' ' LYS . . . . . 0.596 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -60.96 -38.35 85.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -173.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . 0.596 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 2.3 m -72.84 -35.91 67.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.614 0.245 . . . . 0.0 111.06 178.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 10.1 mt -62.94 -47.82 81.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.515 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 103' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -65.09 -26.75 68.36 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.906 0.384 . . . . 0.0 110.53 179.209 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -69.36 -7.45 37.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.828 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . 0.412 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 23.5 m-85 -103.36 -8.24 20.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 0.0 110.938 178.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.14 41.4 1.53 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.243 -0.979 . . . . 0.0 112.735 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -87.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.418 -175.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.17 119.62 35.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.879 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 110' ' ' ILE . . . . . 0.856 HG23 ' HG3' ' B' ' 22' ' ' MET . 1.2 tt -119.46 126.58 75.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.252 0.549 . . . . 0.0 110.818 -176.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 111' ' ' TYR . . . . . 0.538 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 3.1 m-85 -112.95 141.67 46.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.866 -174.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.421 ' HB3' ' CE ' ' B' ' 24' ' ' MET . 0.7 OUTLIER -112.26 139.51 47.74 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.301 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . 0.516 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 0.3 OUTLIER -81.93 119.86 24.48 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -173.266 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . 0.562 ' CG ' ' HB3' ' B' ' 24' ' ' MET . 2.4 mm-40 -82.08 5.19 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.79 177.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -107.99 -99.06 2.59 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.012 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 155.18 166.74 15.82 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 117' ' ' MET . . . . . 0.469 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.1 OUTLIER -59.75 -39.19 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.006 0.431 . . . . 0.0 110.75 -178.208 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 18.6 p-10 -68.78 -23.85 64.35 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.83 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 119' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' B' ' 119' ' ' LYS . 0.1 OUTLIER -73.67 -32.14 63.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.883 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 120' ' ' TRP . . . . . 0.683 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 27.7 t-105 -58.83 -51.46 69.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.736 177.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 11.5 mt -67.3 -40.12 86.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.144 178.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.2 OUTLIER -63.7 -45.93 87.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.665 -176.706 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . 0.854 ' HG2' ' HD3' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -83.69 17.05 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.646 -176.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 67.44 23.05 73.46 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.007 171.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.668 HD12 ' HA ' ' B' ' 120' ' ' TRP . 53.3 mt -75.29 154.54 86.15 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 117.101 0.451 . . . . 0.0 110.347 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -58.65 115.75 2.77 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.046 2.497 . . . . 0.0 112.219 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.17 150.59 52.0 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.181 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 128' ' ' LEU . . . . . 0.472 ' HB2' ' HG2' ' B' ' 56' ' ' LYS . 2.5 mt . . . . . 0 N--CA 1.445 -0.676 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.544 ' HG3' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.332 0 CA-C-O 120.767 0.318 . . . . 0.0 110.331 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.549 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -62.69 -39.8 98.38 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.783 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -65.03 -32.88 74.82 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.266 0.555 . . . . 0.0 110.289 176.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . 0.544 ' HG3' ' HG3' ' A' ' 3' ' ' MET . 17.0 mmtt -64.78 -57.5 8.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 112.252 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.549 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.8 p90 -80.43 -26.65 38.29 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 119.788 -0.765 . . . . 0.0 112.065 -174.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . 0.449 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . 16.0 t70 -53.85 -51.18 64.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.959 0.409 . . . . 0.0 111.176 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.388 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -68.57 -40.62 80.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.932 -175.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.427 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.5 OUTLIER -57.86 -45.96 85.54 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.194 0.521 . . . . 0.0 110.293 -178.402 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.56 ' HD3' ' HG3' ' B' ' 72' ' ' PRO . 1.2 tptp -65.31 -24.98 67.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.083 175.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.18 -44.54 46.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.227 178.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -71.51 -51.3 24.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.613 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.24 -33.63 43.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.979 0.419 . . . . 0.0 110.869 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -37.4 70.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.356 177.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.35 -26.04 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.028 0.442 . . . . 0.0 111.551 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.04 -31.63 66.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.06 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -76.14 -22.43 55.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.42 0.628 . . . . 0.0 110.579 173.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.15 58.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.865 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -76.85 -9.12 58.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.886 -176.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -127.98 171.6 11.69 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.128 -0.357 . . . . 0.0 111.299 -177.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -84.49 109.66 18.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' MET . . . . . 0.721 ' SD ' ' HB3' ' A' ' 112' ' ' ASN . 0.6 OUTLIER -78.02 103.47 7.98 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.7 -174.739 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.596 ' O ' ' HA ' ' A' ' 113' ' ' SER . 7.5 mt -121.1 140.89 51.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.157 0.503 . . . . 0.0 111.316 -177.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 141.77 76.15 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.052 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -44.51 -30.12 3.7 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 124.203 3.269 . . . . 0.0 114.636 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.457 ' HG2' ' OE2' ' A' ' 123' ' ' GLU . 0.4 OUTLIER -73.65 -42.59 61.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.941 0.4 . . . . 0.0 111.142 178.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.38 -33.25 69.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.212 177.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.428 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -65.98 -47.46 74.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.082 176.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TYR . . . . . 0.617 ' HA ' HD12 ' A' ' 34' ' ' LEU . 51.6 t80 -64.2 -30.53 71.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.076 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -52.61 64.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.022 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.423 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -73.73 -27.42 61.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.886 178.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 31' ' ' TYR . 35.2 mt -62.32 -54.65 37.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.302 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLN . . . . . 0.448 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -76.39 -28.03 56.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.04 -174.348 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.448 ' N ' ' HG3' ' A' ' 35' ' ' GLN . 17.7 mt-10 -79.74 -34.13 40.23 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.222 0.534 . . . . 0.0 110.426 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -117.53 94.58 45.92 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.718 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -60.87 -2.83 2.36 Favored 'Trans proline' 0 N--CA 1.474 0.381 0 C-N-CA 123.201 2.6 . . . . 0.0 113.921 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -96.98 -18.92 19.13 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.955 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.502 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 23.5 mt -77.25 108.59 10.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.487 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -100.33 145.2 28.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.515 -173.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.744 HD11 ' HB2' ' A' ' 88' ' ' PHE . 7.8 tp -103.85 129.2 51.29 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.3 mp -112.7 121.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.091 0.472 . . . . 0.0 109.876 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.822 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -98.38 138.87 34.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.844 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.97 95.33 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.489 0.662 . . . . 0.0 109.462 174.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.602 ' HB3' HD13 ' A' ' 51' ' ' LEU . 1.8 tpt85 -152.24 163.85 38.57 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.274 -0.876 . . . . 0.0 108.774 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.49 139.92 31.81 Favored Pre-proline 0 C--N 1.322 -0.61 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.15 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -62.09 -19.32 65.97 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.322 2.681 . . . . 0.0 115.059 -166.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.461 ' HB2' ' OE2' ' B' ' 50' ' ' GLU . 0.1 OUTLIER -76.7 -39.2 52.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.041 -0.664 . . . . 0.0 111.386 -178.927 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.19 -37.55 66.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.602 HD13 ' HB3' ' A' ' 46' ' ' ARG . 0.8 OUTLIER -59.34 -45.84 90.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.234 0.54 . . . . 0.0 110.912 177.327 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -35.52 80.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.85 -177.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.87 -48.52 12.26 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -175.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -92.62 -36.79 12.79 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.578 -0.449 . . . . 0.0 112.199 -173.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.3 173.19 13.51 Favored Glycine 0 N--CA 1.44 -1.097 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.819 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LYS . . . . . 0.566 ' HB2' ' HD2' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -149.04 165.7 17.09 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.729 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.566 ' HD2' ' HB2' ' A' ' 56' ' ' LYS . 18.6 Cg_endo -63.78 123.63 12.3 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 121.881 1.72 . . . . 0.0 112.387 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -94.16 71.97 3.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.072 0.463 . . . . 0.0 110.044 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.5 m -115.94 174.41 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.34 -24.27 32.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.812 0.339 . . . . 0.0 111.383 -176.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -125.43 66.45 1.15 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.384 0.612 . . . . 0.0 111.335 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' TYR . . . . . 0.822 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 0.8 OUTLIER -132.84 139.13 47.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.623 177.332 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.487 ' HE2' HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -135.36 135.72 40.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.975 0.417 . . . . 0.0 110.533 176.399 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.0 t-160 -93.18 115.63 28.25 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.493 178.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.403 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 178.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.487 ' HG ' ' N ' ' A' ' 71' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.962 ' HB3' ' HB3' ' B' ' 11' ' ' PHE . 0.0 OUTLIER -45.01 -57.62 6.85 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.757 -174.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.519 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 74.0 Cg_endo -73.65 -15.87 24.14 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.051 1.834 . . . . 0.0 112.605 178.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.467 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -81.29 -22.32 38.68 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.283 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.685 HD21 HD21 ' A' ' 102' ' ' LEU . 3.7 tp -58.31 -53.16 61.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.137 177.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.01 -27.38 68.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.585 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.91 -22.54 39.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.755 0.312 . . . . 0.0 111.235 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' SER . . . . . 0.465 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 49.8 m -79.57 -35.82 39.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.9 -177.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.18 63.39 1.04 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.521 -0.847 . . . . 0.0 111.869 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.7 mt -110.45 136.67 49.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.574 0.226 . . . . 0.0 110.408 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASP . . . . . 0.503 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -121.52 138.81 28.81 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.238 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PRO . . . . . 0.43 ' HG3' ' SD ' ' B' ' 3' ' ' MET . 31.9 Cg_endo -68.56 8.01 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.903 2.402 . . . . 0.0 113.719 -174.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -102.27 -17.44 15.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 122.106 -0.371 . . . . 0.0 110.616 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.503 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -93.69 126.19 50.64 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.684 178.499 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.621 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 18.1 Cg_exo -65.36 143.75 77.68 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.769 2.313 . . . . 0.0 111.362 177.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.509 HG23 HD12 ' A' ' 110' ' ' ILE . 2.4 m -137.72 149.65 25.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.076 0.465 . . . . 0.0 111.046 -178.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.564 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 0.7 OUTLIER -125.74 142.91 41.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.488 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.447 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 2.9 m -103.4 134.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.951 0.405 . . . . 0.0 110.608 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' PHE . . . . . 0.744 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -120.12 141.47 49.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.939 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 46.8 t . . . . . 0 C--O 1.235 0.309 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.887 177.696 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.447 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . . . . . . 0 N--CA 1.464 0.257 0 CA-C-O 120.971 0.415 . . . . 0.0 111.299 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -28.56 69.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.287 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.74 -38.89 92.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.695 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.9 -46.76 33.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.693 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -65.46 -55.48 20.47 Favored Glycine 0 CA--C 1.519 0.299 0 C-N-CA 121.058 -0.591 . . . . 0.0 113.57 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LYS . . . . . 0.551 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -61.86 -32.86 73.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.813 0.34 . . . . 0.0 111.199 -174.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' THR . . . . . 0.479 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 44.1 m -72.88 -38.74 66.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.782 0.325 . . . . 0.0 110.974 177.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . 0.685 HD21 HD21 ' A' ' 74' ' ' LEU . 11.6 mt -64.3 -45.2 89.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.47 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.1 -27.47 68.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.919 0.39 . . . . 0.0 110.597 179.157 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.19 -6.73 41.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.368 178.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' TYR . . . . . 0.454 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 22.6 m-85 -104.21 -5.42 21.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.784 0.326 . . . . 0.0 110.543 176.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 107.07 34.61 2.93 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.952 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -78.23 139.27 38.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.682 0.277 . . . . 0.0 110.44 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -60.85 3.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.751 -172.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.621 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -139.23 120.01 14.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.294 -178.573 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ILE . . . . . 0.546 HG21 ' HB3' ' A' ' 103' ' ' ARG . 0.7 OUTLIER -121.37 127.16 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.23 0.538 . . . . 0.0 111.397 -176.712 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.564 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 1.9 m-85 -118.52 145.76 45.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.261 -176.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ASN . . . . . 0.721 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 38.4 t-20 -117.12 143.41 45.84 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.596 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -97.23 115.46 27.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -172.851 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLU . . . . . 0.471 ' HG3' ' HB3' ' A' ' 24' ' ' MET . 2.9 mm-40 -76.32 33.96 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -139.84 -78.44 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.315 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 114.02 178.8 19.14 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.548 179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' MET . . . . . 0.432 ' SD ' ' HD3' ' A' ' 57' ' ' PRO . 10.4 tpp -53.61 -38.49 64.07 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.017 0.437 . . . . 0.0 111.178 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -58.48 -41.66 85.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.573 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.8 -32.66 63.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.355 179.598 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.612 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -61.11 -53.66 54.26 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 9.1 mt -63.68 -42.19 98.06 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.109 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.41 -41.49 93.53 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.804 -177.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLU . . . . . 0.564 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -67.08 -21.2 65.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.913 0.387 . . . . 0.0 110.972 -177.343 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 90.5 21.87 36.14 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.883 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.564 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 24.3 mt -75.97 159.53 80.54 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 177.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.493 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 14.4 Cg_endo -54.17 114.03 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.973 2.449 . . . . 0.0 111.704 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.05 148.78 41.93 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 120.991 0.424 . . . . 0.0 110.698 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.5 mt -97.02 100.77 12.26 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.312 -1.038 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -175.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' MET . . . . . 0.437 ' HG2' ' HG3' ' B' ' 6' ' ' LYS . 14.1 mtp . . . . . 0 C--O 1.233 0.201 0 CA-C-O 120.654 0.264 . . . . 0.0 111.374 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' GLY . . . . . 0.596 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.49 -35.03 78.04 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.319 -0.467 . . . . 0.0 113.434 -177.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.83 -31.88 66.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.012 0.434 . . . . 0.0 110.561 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LYS . . . . . 0.503 ' HD3' ' HA ' ' B' ' 6' ' ' LYS . 6.2 mmtt -71.31 -57.8 4.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.134 -173.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.596 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.6 p90 -73.01 -35.59 66.84 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.103 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.33 -56.08 22.1 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.83 0.348 . . . . 0.0 110.877 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.08 -46.55 85.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.801 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.53 -41.87 92.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.536 -177.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' PHE . . . . . 0.962 ' HB3' ' HB3' ' A' ' 71' ' ' GLU . 0.3 OUTLIER -54.11 -43.89 70.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.217 0.532 . . . . 0.0 110.525 -178.045 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -65.24 -24.43 67.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.619 177.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.41 -49.78 21.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.38 . . . . 0.0 110.853 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' GLN . . . . . 0.405 ' OE1' HG23 ' A' ' 101' ' ' THR . 65.2 mt-30 -71.33 -52.0 21.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.896 -178.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.411 ' HB ' ' O ' ' B' ' 11' ' ' PHE . 0.8 OUTLIER -56.29 -33.47 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.146 -177.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -70.94 -34.92 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.2 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -26.74 68.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.934 0.397 . . . . 0.0 111.065 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.17 72.03 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.631 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' LYS . . . . . 0.532 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 6.9 mtmt -76.07 -22.38 55.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.351 0.596 . . . . 0.0 111.008 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.28 -19.02 61.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.122 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.62 -5.46 56.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.527 -177.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' MET . . . . . 0.924 ' HG3' HG23 ' B' ' 110' ' ' ILE . 1.5 mpp? -122.16 176.33 5.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.567 0.222 . . . . 0.0 110.79 -179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 31.5 t -88.37 105.03 15.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' MET . . . . . 0.532 ' SD ' ' HB3' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -75.68 111.28 10.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.998 0.428 . . . . 0.0 110.767 -175.223 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' B' ' 25' ' ' LEU . 5.2 mt -124.17 144.29 50.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.081 -176.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.15 146.04 61.97 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.547 176.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -51.52 -21.56 10.84 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.522 2.815 . . . . 0.0 114.104 -175.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -75.03 -47.45 28.95 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.053 0.454 . . . . 0.0 110.821 175.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.02 -32.63 72.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.82 -47.79 61.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.967 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' TYR . . . . . 0.512 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 86.2 t80 -67.02 -29.73 69.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.748 178.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.96 -53.51 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.82 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -74.08 -27.59 60.97 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.01 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.607 HD11 ' HB2' ' B' ' 42' ' ' LEU . 0.2 OUTLIER -62.53 -45.84 91.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.136 178.454 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -75.87 -26.99 57.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.487 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 -29.43 26.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.813 0.339 . . . . 0.0 110.771 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -125.68 98.73 33.77 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.268 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.64 2.74 1.8 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.13 2.554 . . . . 0.0 112.871 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -90.33 -20.77 22.51 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ILE . . . . . 0.582 HG12 ' HB2' ' B' ' 84' ' ' PRO . 41.1 mt -80.22 112.52 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.123 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' THR . . . . . 0.561 ' HB ' HG12 ' B' ' 85' ' ' VAL . 1.9 m -94.72 140.64 29.62 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.057 -178.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.845 HD11 ' HB2' ' B' ' 88' ' ' PHE . 8.0 tp -105.12 123.82 48.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' ILE . . . . . 0.417 ' HA ' ' O ' ' B' ' 63' ' ' LYS . 2.1 mp -110.29 115.53 49.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.573 177.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' ASP . . . . . 0.809 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.3 OUTLIER -99.06 140.51 33.11 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.553 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.87 94.7 2.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.655 0.741 . . . . 0.0 109.84 174.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' ARG . . . . . 0.654 ' HD3' ' SD ' ' B' ' 117' ' ' MET . 21.0 mtp85 -145.44 164.18 32.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.362 178.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -73.28 134.25 80.27 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.242 -173.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -65.05 -21.39 63.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.449 2.766 . . . . 0.0 114.621 -169.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.35 -31.31 48.5 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.251 -0.579 . . . . 0.0 110.268 177.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' GLU . . . . . 0.461 ' OE2' ' HB2' ' A' ' 49' ' ' ASP . 2.3 mm-40 -70.91 -40.88 71.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.046 173.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.778 HD23 ' HD3' ' B' ' 56' ' ' LYS . 0.5 OUTLIER -60.2 -33.57 72.42 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.605 176.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -39.12 54.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.512 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.47 -46.83 13.98 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 4.1 mtm -97.65 -35.06 10.71 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.716 -0.393 . . . . 0.0 111.5 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.42 173.17 14.2 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.262 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' LYS . . . . . 0.778 ' HD3' HD23 ' B' ' 51' ' ' LEU . 0.0 OUTLIER -138.82 156.73 72.65 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.401 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' PRO . . . . . 0.487 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 16.4 Cg_endo -60.8 125.21 16.64 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.647 2.231 . . . . 0.0 112.956 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . 0.791 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 17.7 t0 -97.5 96.3 8.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.236 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' VAL . . . . . 0.684 HG22 ' HB2' ' B' ' 62' ' ' TYR . 34.9 m -130.89 164.65 33.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.302 176.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -38.95 77.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.564 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -124.6 75.89 1.45 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.14 0.495 . . . . 0.0 110.851 -177.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' TYR . . . . . 0.809 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 13.5 t80 -118.08 126.02 51.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.451 -178.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 43' ' ' ILE . 15.4 mttm -128.04 120.48 27.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.964 0.412 . . . . 0.0 110.346 178.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' HIS . . . . . 0.481 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 11.5 t-160 -95.83 114.2 25.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' MET . . . . . 0.443 ' SD ' ' HA ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.322 -0.614 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 177.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' LEU . . . . . 0.53 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER . . . . . 0 CA--C 1.514 -0.407 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' GLU . . . . . 0.53 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.3 -60.32 4.21 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.295 -175.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' PRO . . . . . 0.56 ' HG3' ' HD3' ' A' ' 12' ' ' LYS . 3.5 Cg_exo -74.66 -16.36 21.16 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.692 2.261 . . . . 0.0 112.916 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -91.11 -21.74 21.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.678 0.275 . . . . 0.0 111.458 -174.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' LEU . . . . . 0.711 HD21 HD21 ' B' ' 102' ' ' LEU . 3.4 tp -61.02 -51.27 69.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.607 -173.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' ALA . . . . . 0.449 ' CB ' ' HB2' ' A' ' 8' ' ' ASP . . . -74.1 -17.49 60.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -76.15 -24.7 54.84 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -176.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.64 -28.0 51.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.8 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.67 83.41 1.56 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.303 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.0 mt -126.0 144.68 50.61 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.199 -0.296 . . . . 0.0 110.199 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -114.11 130.51 23.85 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.602 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' PRO . . . . . 0.651 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 33.8 Cg_endo -68.47 -6.81 18.55 Favored 'Trans proline' 0 N--CA 1.472 0.255 0 C-N-CA 122.921 2.414 . . . . 0.0 113.912 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -98.95 2.58 46.57 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.42 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' B' ' 83' ' ' LYS . 33.3 mmtm -106.76 142.66 25.44 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.132 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' PRO . . . . . 0.582 ' HB2' HG12 ' B' ' 40' ' ' ILE . 16.9 Cg_exo -69.35 134.71 29.53 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.545 2.163 . . . . 0.0 111.859 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' VAL . . . . . 0.561 HG12 ' HB ' ' B' ' 41' ' ' THR . 5.6 m -135.65 147.91 28.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.39 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' VAL . . . . . 0.557 HG13 HD12 ' B' ' 42' ' ' LEU . 0.5 OUTLIER -126.5 141.42 46.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.784 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 m -103.28 122.1 55.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.057 0.456 . . . . 0.0 110.062 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' PHE . . . . . 0.845 ' HB2' HD11 ' B' ' 42' ' ' LEU . 7.3 t80 -110.28 143.87 39.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.702 -175.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 53.4 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.92 177.111 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.932 0.396 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 96' ' ' ALA . . . . . 0.408 ' N ' HD21 ' B' ' 112' ' ' ASN . . . -60.97 -28.99 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.513 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -40.4 90.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.965 0.412 . . . . 0.0 110.502 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 98' ' ' ALA . . . . . 0.427 ' HA ' ' HZ ' ' A' ' 11' ' ' PHE . . . -70.37 -40.42 74.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.72 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 99' ' ' GLY . . . . . 0.448 ' HA2' HD11 ' B' ' 110' ' ' ILE . . . -76.92 -49.87 7.36 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.799 -0.715 . . . . 0.0 113.615 -176.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 100' ' ' LYS . . . . . 0.601 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -64.79 -30.14 71.14 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.558 -0.378 . . . . 0.0 111.873 -172.238 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 3.2 m -72.03 -35.9 69.52 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.12 0.486 . . . . 0.0 110.163 175.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 102' ' ' LEU . . . . . 0.711 HD21 HD21 ' B' ' 74' ' ' LEU . 9.2 mt -67.1 -42.69 84.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.736 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 103' ' ' ARG . . . . . 0.601 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -62.25 -27.28 68.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.986 0.422 . . . . 0.0 110.497 179.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -6.75 42.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.736 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -104.38 -7.99 19.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.836 0.351 . . . . 0.0 110.634 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 111.52 15.28 10.49 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.655 175.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 107' ' ' PHE . . . . . 0.651 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 6.7 m-85 -61.88 125.79 25.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.793 0.33 . . . . 0.0 110.495 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -76.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.077 -172.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 109' ' ' THR . . . . . 0.553 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -117.33 104.4 11.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.523 -174.172 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 110' ' ' ILE . . . . . 0.924 HG23 ' HG3' ' B' ' 22' ' ' MET . 1.5 tt -114.97 125.75 72.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.164 0.507 . . . . 0.0 110.967 -176.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 111' ' ' TYR . . . . . 0.465 ' CD1' ' HB ' ' B' ' 86' ' ' VAL . 1.1 m-85 -115.3 143.79 44.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.776 -175.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 112' ' ' ASN . . . . . 0.408 HD21 ' N ' ' B' ' 96' ' ' ALA . 0.7 OUTLIER -114.28 143.34 45.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 88.7 p -79.74 129.09 34.18 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.839 0.352 . . . . 0.0 111.53 -172.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -97.61 8.18 45.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.082 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -122.3 -96.16 1.33 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.741 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 156.64 172.81 24.37 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.007 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 117' ' ' MET . . . . . 0.654 ' SD ' ' HD3' ' B' ' 46' ' ' ARG . 36.1 ttm -62.25 -35.38 78.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.08 0.467 . . . . 0.0 110.22 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -33.56 74.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.194 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.01 -33.81 66.0 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.035 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 120' ' ' TRP . . . . . 0.65 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.6 t-105 -58.68 -51.9 67.97 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 18.7 mt -62.93 -40.01 96.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.992 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.71 -43.33 80.3 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.335 -175.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.4 0.87 10.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.663 0.268 . . . . 0.0 111.244 -176.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 76.74 24.43 67.29 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.043 -0.598 . . . . 0.0 112.337 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 125' ' ' LEU . . . . . 0.524 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 77.6 mt -77.39 161.29 73.06 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 126' ' ' PRO . . . . . 0.524 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 38.2 Cg_endo -66.86 129.86 21.82 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.781 2.321 . . . . 0.0 112.29 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.74 148.73 52.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.814 0.34 . . . . 0.0 110.773 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 128' ' ' LEU . . . . . 0.791 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.7 mt . . . . . 0 C--N 1.325 -0.465 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 175.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.112 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -167.72 42.62 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.863 -1.062 . . . . 0.0 109.741 -171.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.559 ' SD ' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -80.34 19.36 0.78 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.069 -0.514 . . . . 0.0 112.03 -176.304 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.653 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -58.95 -38.32 92.55 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-N 116.163 -0.471 . . . . 0.0 112.961 179.684 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -71.42 -38.67 71.39 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.985 0.421 . . . . 0.0 110.488 177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.559 ' HG3' ' SD ' ' A' ' 3' ' ' MET . 7.7 mmtt -60.54 -56.37 22.2 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.534 -176.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.653 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 1.1 p90 -76.46 -21.96 55.19 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 119.89 -0.724 . . . . 0.0 111.793 -175.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.713 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 0.0 OUTLIER -52.45 -46.11 66.34 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 123.447 0.467 . . . . 0.0 111.013 -178.103 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.43 -42.03 81.59 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.342 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.489 ' HB ' ' CE1' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -67.61 -43.13 81.19 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.287 -179.596 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.503 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.6 OUTLIER -57.69 -44.45 85.85 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.301 179.282 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.661 ' HD2' ' HG3' ' A' ' 16' ' ' LYS . 0.1 OUTLIER -66.46 -26.52 67.24 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.373 178.117 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.86 -42.37 63.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.078 178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -72.0 -51.03 23.8 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.173 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.1 t -64.77 -38.37 82.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.237 -173.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.661 ' HG3' ' HD2' ' A' ' 12' ' ' LYS . 0.9 OUTLIER -69.55 -32.62 71.52 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.685 0.279 . . . . 0.0 111.368 -177.808 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.24 -26.12 66.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.384 178.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.38 -36.11 80.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.136 -178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -78.03 -22.28 49.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.288 0.566 . . . . 0.0 110.962 174.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.43 -19.13 50.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.544 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -62.78 -33.81 75.97 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.028 -0.533 . . . . 0.0 112.12 -174.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.684 ' HB3' ' HD3' ' A' ' 103' ' ' ARG . 8.6 ptm -116.99 -172.61 2.24 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.211 0.529 . . . . 0.0 112.274 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.6 t -79.84 112.96 18.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.272 178.358 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.59 120.97 29.44 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.019 0.437 . . . . 0.0 110.491 -178.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 25' ' ' LEU . 2.3 mt -118.2 -168.47 1.53 Allowed 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.843 -0.617 . . . . 0.0 109.902 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -126.61 144.13 48.7 Favored Pre-proline 0 C--N 1.316 -0.86 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 173.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.423 ' HB2' ' CD1' ' A' ' 125' ' ' LEU . 1.2 Cg_endo -46.77 -30.37 9.19 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 123.933 3.089 . . . . 0.0 114.209 -174.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.7 mtmm -75.02 -43.8 51.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.943 0.401 . . . . 0.0 110.792 176.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.2 -32.24 73.55 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.393 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.639 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.01 -47.97 40.42 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.949 -1.023 . . . . 0.0 110.78 178.155 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.708 ' HA ' HD12 ' A' ' 34' ' ' LEU . 83.9 t80 -62.97 -33.41 75.33 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.862 178.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tptt -53.9 -52.57 60.11 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.187 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.502 HD13 HG21 ' A' ' 40' ' ' ILE . 0.2 OUTLIER -74.05 -26.18 60.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.364 179.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.708 HD12 ' HA ' ' A' ' 31' ' ' TYR . 99.0 mt -65.64 -48.77 71.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.996 0.427 . . . . 0.0 111.275 179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -75.69 -28.55 58.69 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.707 -174.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -86.59 -37.02 18.51 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.11 0.481 . . . . 0.0 110.511 -177.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -116.48 97.43 50.0 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.77 179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.566 ' HA ' ' ND2' ' A' ' 61' ' ' ASN . 35.7 Cg_endo -67.02 3.73 1.45 Allowed 'Trans proline' 0 CA--C 1.53 0.303 0 C-N-CA 122.912 2.408 . . . . 0.0 112.902 -178.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -91.38 -27.94 18.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.015 0.436 . . . . 0.0 110.24 176.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.508 HG12 ' HG2' ' A' ' 84' ' ' PRO . 25.0 mt -81.88 109.74 16.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.817 175.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.675 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.1 OUTLIER -99.08 145.65 26.91 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.697 -175.16 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.651 HD11 ' HB2' ' A' ' 88' ' ' PHE . 2.7 tp -101.44 133.26 46.34 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.6 mt -112.77 117.1 54.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.877 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.529 176.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.856 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.1 OUTLIER -99.21 138.38 36.4 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.666 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -126.17 98.73 5.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.534 177.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.797 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -156.76 162.89 39.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.445 178.551 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.797 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 3.4 m-20 -80.68 157.97 71.45 Favored Pre-proline 0 C--N 1.318 -0.777 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.162 -174.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 36.6 Cg_endo -72.1 -23.1 21.83 Favored 'Trans proline' 0 CA--C 1.529 0.235 0 C-N-CA 122.859 2.373 . . . . 0.0 114.758 -170.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.454 ' HB2' ' HG3' ' B' ' 50' ' ' GLU . 3.7 t70 -78.14 -37.86 45.04 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 119.704 -0.798 . . . . 0.0 111.763 -177.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.405 ' CD ' HH21 ' A' ' 46' ' ' ARG . 1.4 tt0 -70.53 -39.28 74.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.749 175.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.845 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 mp -59.56 -34.8 73.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.293 177.059 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -78.94 -45.13 21.07 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.164 -179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.54 -47.97 13.43 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -173.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 6.4 mmm -98.63 -36.25 9.94 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.855 -0.338 . . . . 0.0 111.629 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 173.3 14.15 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.831 -0.699 . . . . 0.0 112.536 177.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.845 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -143.64 162.28 42.42 Favored Pre-proline 0 C--N 1.325 -0.482 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.199 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.46 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.5 Cg_endo -59.53 133.34 51.2 Favored 'Trans proline' 0 C--N 1.346 0.414 0 C-N-CA 122.391 2.061 . . . . 0.0 113.156 -177.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -95.9 95.36 8.19 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.063 174.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 1.048 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -129.88 145.08 36.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.289 -178.377 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.25 -39.84 95.73 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.308 -176.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.675 ' HB2' HG23 ' A' ' 41' ' ' THR . 0.8 OUTLIER -110.89 76.8 1.0 Allowed 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.255 -178.566 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 1.048 ' HB2' HG23 ' A' ' 59' ' ' VAL . 4.9 t80 -120.34 125.92 49.22 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.162 -171.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.461 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 2.6 mtmt -122.88 113.12 18.7 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.743 -0.466 . . . . 0.0 109.743 174.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 62' ' ' TYR . 11.5 t-160 -92.39 113.08 25.25 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.993 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -114.01 103.31 11.02 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.744 -174.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.438 ' HB2' ' H ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -91.96 -105.09 0.11 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -174.145 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.619 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER 57.1 -131.64 1.51 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 -171.624 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.612 ' O ' ' HA ' ' B' ' 92' ' ' ALA . . . -95.25 -45.33 3.05 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 119.449 -1.358 . . . . 0.0 110.754 174.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.99 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -152.05 43.09 0.7 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.742 -0.229 . . . . 0.0 110.81 173.097 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.993 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 70.54 -2.52 2.18 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.06 -0.973 . . . . 0.0 113.13 173.594 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.634 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.2 OUTLIER -45.88 -63.94 1.1 Allowed Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -176.622 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.634 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 7.7 Cg_exo -74.49 -16.11 21.76 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 122.4 2.066 . . . . 0.0 113.159 -178.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.801 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.8 OUTLIER -90.71 -15.66 29.89 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.631 -0.259 . . . . 0.0 111.33 -175.255 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.681 HD13 HD11 ' A' ' 70' ' ' LEU . 42.8 tp -57.13 -53.28 59.83 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.3 0.571 . . . . 0.0 110.729 -178.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.439 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -69.39 -22.6 63.7 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.357 -179.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 4.3 mttm -73.8 -30.12 62.55 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.765 -175.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.461 ' HB2' ' HD2' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -78.18 -37.36 45.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 120.94 0.4 . . . . 0.0 110.449 -178.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 102.98 86.8 1.97 Allowed Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.627 -176.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.48 145.12 51.48 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.872 0.368 . . . . 0.0 111.097 -177.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.41 ' OD1' ' HD2' ' A' ' 81' ' ' PRO . 3.1 t0 -129.15 146.58 61.39 Favored Pre-proline 0 C--N 1.326 -0.448 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.498 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 40.9 Cg_endo -69.77 9.19 0.62 Allowed 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.987 2.458 . . . . 0.0 113.872 -175.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -116.49 18.61 15.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.322 0.582 . . . . 0.0 110.004 174.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -111.63 127.37 26.98 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.442 -179.441 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.508 ' HG2' HG12 ' A' ' 40' ' ' ILE . 5.9 Cg_exo -75.57 129.35 11.76 Favored 'Trans proline' 0 N--CA 1.458 -0.596 0 C-N-CA 122.426 2.084 . . . . 0.0 111.172 177.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.502 HG23 HD12 ' A' ' 110' ' ' ILE . 0.0 OUTLIER -139.11 151.04 23.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-O 120.93 0.395 . . . . 0.0 111.053 -177.183 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.8 p -127.32 144.83 36.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 N-CA-C 109.477 -0.564 . . . . 0.0 109.477 177.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.558 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 8.2 m -112.15 142.24 25.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.734 0.302 . . . . 0.0 110.725 -178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.769 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.0 OUTLIER -108.69 158.2 17.83 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.495 -178.667 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' CYS . . . . . 0.667 ' HB3' ' HB3' ' A' ' 93' ' ' ALA . 1.0 OUTLIER 67.47 62.75 0.44 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.417 0.627 . . . . 0.0 111.481 179.563 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.666 ' HA ' ' HB3' ' A' ' 95' ' ' ALA . 0.3 OUTLIER -62.35 -49.37 75.87 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -174.78 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.467 ' HB ' ' S5 ' ' A' ' 138' ' ' PS5 . 0.0 OUTLIER -76.5 -86.08 0.05 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -168.022 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -55.71 -56.84 15.76 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -172.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.667 ' HB3' ' HB3' ' A' ' 89' ' ' CYS . . . -64.82 -26.92 68.55 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.436 -179.218 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER 74.87 58.45 0.07 Allowed 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.541 178.423 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.666 ' HB3' ' HA ' ' A' ' 90' ' ' LYS . . . -64.01 -20.86 66.21 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.268 0.556 . . . . 0.0 109.908 172.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.0 -33.49 70.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.712 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -74.23 -30.39 62.15 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.34 176.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.84 -40.73 54.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.745 -177.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.47 -46.12 3.31 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.518 -0.849 . . . . 0.0 113.598 -172.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.497 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.41 -24.24 67.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.705 0.288 . . . . 0.0 111.227 -174.29 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.43 -49.65 66.01 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.442 175.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.532 HD21 HD21 ' A' ' 74' ' ' LEU . 39.4 mt -58.48 -41.95 86.44 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.446 -175.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.684 ' HD3' ' HB3' ' A' ' 22' ' ' MET . 0.0 OUTLIER -71.53 -27.12 62.97 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.69 0.281 . . . . 0.0 110.578 177.356 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.38 -9.35 58.51 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.705 175.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.483 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 19.4 m-85 -100.24 -40.86 7.34 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 176.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 144.56 41.13 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.334 -0.936 . . . . 0.0 113.259 175.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.438 ' CE1' HD22 ' A' ' 102' ' ' LEU . 4.0 m-85 -88.05 138.76 31.16 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.931 0.366 . . . . 0.0 110.367 177.25 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 1.2 mtpt -61.32 -72.83 0.11 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.874 -174.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.86 107.44 10.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.064 0.459 . . . . 0.0 111.247 -176.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.502 HD12 HG23 ' A' ' 85' ' ' VAL . 1.2 tt -117.61 132.73 66.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.566 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -115.0 146.09 41.59 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.578 -177.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.439 ' OD1' ' HB3' ' A' ' 90' ' ' LYS . 5.7 t-20 -113.21 141.33 47.09 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 172.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 16.0 m -96.31 111.71 23.69 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.732 0.301 . . . . 0.0 111.806 -174.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.406 ' HG3' ' N ' ' A' ' 115' ' ' GLY . 1.8 tp10 -62.05 149.7 40.3 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.099 177.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.621 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 89.86 -108.4 3.51 Favored Glycine 0 N--CA 1.442 -0.92 0 C-N-CA 120.751 -0.737 . . . . 0.0 111.583 -176.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.53 -161.46 32.68 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 111.434 -0.666 . . . . 0.0 111.434 179.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' MET . . . . . 0.434 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 35.9 tpp -60.5 -32.65 71.65 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.042 0.448 . . . . 0.0 110.725 179.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -61.79 -33.91 74.96 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.268 179.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.621 ' HD3' ' HA3' ' A' ' 115' ' ' GLY . 0.0 OUTLIER -73.85 -33.13 63.97 Favored 'General case' 0 N--CA 1.452 -0.361 0 N-CA-C 111.42 0.155 . . . . 0.0 111.42 -179.775 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.769 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -62.77 -54.04 45.11 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 120.728 -0.389 . . . . 0.0 110.206 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 15.6 mt -62.12 -43.81 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.378 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -74.79 -33.42 62.25 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.632 0.605 . . . . 0.0 112.632 -172.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -76.94 3.24 12.61 Favored 'General case' 0 C--N 1.329 -0.311 0 O-C-N 122.269 -0.269 . . . . 0.0 111.669 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.11 18.55 74.33 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.359 177.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.516 HD12 ' HA ' ' A' ' 120' ' ' TRP . 86.8 mt -76.52 154.24 83.75 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-O 120.834 0.349 . . . . 0.0 110.552 -178.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.481 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 26.4 Cg_endo -57.98 111.25 0.79 Allowed 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 123.066 2.511 . . . . 0.0 111.951 179.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.84 146.97 47.08 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 179.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -95.88 101.55 13.24 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 173.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -132.02 142.45 49.57 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.915 -175.529 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.71 70.06 10.75 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.789 -0.448 . . . . 0.0 109.789 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.52 104.51 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.983 -176.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 55.9 p-80 -122.5 136.17 54.82 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.616 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -116.48 -3.25 11.88 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.579 -178.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 23.6 t60 -80.09 64.87 5.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.024 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -163.96 130.43 3.15 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.083 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.47 -52.59 2.77 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 173.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.254 1.339 0 CA-C-O 117.61 -1.186 . . . . 0.0 108.777 172.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.058 0 N-CA-C 110.167 -0.308 . . . . 0.0 110.167 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -149.35 127.78 12.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.354 0.597 . . . . 0.0 109.898 175.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' MET . . . . . 0.604 ' SD ' ' HG3' ' B' ' 6' ' ' LYS . 4.8 tpp -112.75 24.14 12.75 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.066 -176.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.756 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.05 -49.19 81.11 Favored Glycine 0 N--CA 1.448 -0.563 0 CA-C-N 115.599 -0.728 . . . . 0.0 113.276 -177.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.8 -31.91 68.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.064 0.459 . . . . 0.0 111.117 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.604 ' HG3' ' SD ' ' B' ' 3' ' ' MET . 15.0 mmtp -75.57 -57.99 3.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.406 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.756 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -79.23 -23.6 43.63 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 119.858 -0.737 . . . . 0.0 112.485 -174.489 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . 0.439 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 17.8 t0 -53.82 -42.45 68.44 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.996 0.427 . . . . 0.0 110.536 -178.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.44 -35.34 68.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.307 178.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.06 -47.53 68.06 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.458 0.171 . . . . 0.0 111.417 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' PHE . . . . . 0.568 ' CD2' HD22 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -57.23 -38.47 73.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.29 0.567 . . . . 0.0 110.317 179.563 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.1 OUTLIER -68.08 -27.06 66.16 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.371 178.447 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.91 -44.29 49.55 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.221 178.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 19.8 mt-30 -69.74 -50.59 41.97 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.29 -179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.582 HG11 ' HG2' ' A' ' 71' ' ' GLU . 0.9 OUTLIER -61.57 -33.27 56.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.304 -178.628 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.575 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -71.69 -33.73 69.06 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.423 179.485 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.17 -26.54 64.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.122 0.486 . . . . 0.0 110.888 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.73 -32.84 70.16 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.617 -0.72 . . . . 0.0 112.061 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.39 -24.2 42.77 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.06 0.457 . . . . 0.0 111.024 173.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.38 -26.19 46.48 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.057 -176.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.574 ' O ' ' HD3' ' B' ' 103' ' ' ARG . 3.8 t0 -85.86 21.03 2.01 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.659 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . . . . . . . . . 9.7 mtp -143.38 156.03 44.57 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.468 -178.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 61.2 t -81.76 100.09 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 173.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' MET . . . . . 0.408 ' SD ' ' HG2' ' B' ' 114' ' ' GLU . 0.0 OUTLIER -74.67 112.85 11.28 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.168 0.509 . . . . 0.0 111.111 -174.75 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.47 HD23 ' HA ' ' B' ' 25' ' ' LEU . 2.5 mt -123.76 144.81 49.46 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.198 -179.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.5 141.71 49.18 Favored Pre-proline 0 C--N 1.319 -0.75 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.203 179.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.441 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 1.6 Cg_endo -46.77 -24.17 2.86 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.404 3.403 . . . . 0.0 115.083 -174.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 20.5 mtmm -74.43 -43.78 54.73 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.0 0.428 . . . . 0.0 110.626 177.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -72.65 -32.56 65.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.009 175.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.656 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -66.09 -52.2 50.97 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.778 178.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' TYR . . . . . 0.798 ' HA ' HD12 ' B' ' 34' ' ' LEU . 59.8 t80 -63.66 -29.87 71.05 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 122.221 -0.299 . . . . 0.0 111.063 -179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.28 -52.75 63.36 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.056 179.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.651 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.2 OUTLIER -68.95 -26.51 65.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.259 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.798 HD12 ' HA ' ' B' ' 31' ' ' TYR . 46.8 mt -70.62 -49.69 44.9 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.023 0.439 . . . . 0.0 111.261 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -76.28 -24.65 54.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.233 -173.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -90.65 -34.19 15.53 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.129 -178.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.53 ' HB2' HG13 ' B' ' 40' ' ' ILE . 0.5 OUTLIER -126.64 102.28 26.03 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.563 -177.46 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_exo -70.23 8.29 0.91 Allowed 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 123.327 2.685 . . . . 0.0 113.947 -176.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -92.33 -27.41 17.58 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.283 0.563 . . . . 0.0 109.588 173.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.913 HG12 ' HG2' ' B' ' 84' ' ' PRO . 2.8 mt -82.53 99.41 5.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.408 -0.815 . . . . 0.0 109.841 175.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.631 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -90.28 145.17 25.19 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.362 -176.096 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.928 HD11 ' HB2' ' B' ' 88' ' ' PHE . 2.5 tp -102.89 130.3 49.89 Favored 'General case' 0 CA--C 1.515 -0.393 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.564 HG12 ' HE2' ' B' ' 65' ' ' MET . 94.4 mt -109.01 118.7 57.12 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.807 178.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.825 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -97.13 122.48 40.18 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 176.633 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -118.56 98.41 6.43 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 115.045 -0.98 . . . . 0.0 108.632 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . 0.634 ' HG3' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -161.41 169.89 21.07 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.993 -174.123 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.96 142.44 76.31 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 177.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -78.81 -19.23 11.22 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.683 2.255 . . . . 0.0 114.028 -174.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.41 -48.88 25.04 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 122.097 -0.377 . . . . 0.0 111.391 -176.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' GLU . . . . . 0.454 ' HG3' ' HB2' ' A' ' 49' ' ' ASP . 0.9 OUTLIER -67.74 -29.33 68.53 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 174.561 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.3 -44.5 97.11 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.051 174.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 16.3 mtpt -59.39 -38.68 81.15 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.98 178.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.61 -47.98 10.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.662 -0.699 . . . . 0.0 112.823 -171.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.71 -34.68 11.85 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -170.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.87 163.64 11.31 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.655 178.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.04 152.58 70.32 Favored Pre-proline 0 C--N 1.327 -0.4 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -58.39 122.79 12.27 Favored 'Trans proline' 0 CA--C 1.53 0.278 0 C-N-CA 122.521 2.147 . . . . 0.0 112.893 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -98.61 79.72 2.49 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.339 0.59 . . . . 0.0 110.272 177.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.631 HG22 ' HB2' ' B' ' 62' ' ' TYR . 1.2 m -113.43 162.78 11.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.616 178.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.14 -41.33 88.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.992 0.425 . . . . 0.0 111.315 -174.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.434 ' HB2' HG23 ' B' ' 41' ' ' THR . 19.9 p30 -121.26 67.84 0.88 Allowed 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.522 0.677 . . . . 0.0 111.208 -177.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.825 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -105.52 125.32 50.85 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.808 176.736 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.631 ' HE2' HG21 ' B' ' 41' ' ' THR . 3.7 mtmt -123.01 120.88 34.67 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.004 0.431 . . . . 0.0 110.617 176.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' HIS . . . . . 0.464 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 12.9 t-160 -87.22 113.69 23.18 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 178.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' MET . . . . . 0.923 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.1 OUTLIER -105.68 91.78 3.9 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 -178.17 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -107.29 107.93 19.08 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.245 0.545 . . . . 0.0 112.212 -172.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' ARG . . . . . 0.694 ' HG2' ' HG2' ' B' ' 72' ' ' PRO . 1.1 tpt180 -144.47 -129.43 0.08 Allowed 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 170.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . 0.439 ' HA3' HG22 ' A' ' 91' ' ' THR . . . -85.51 -44.22 6.24 Favored Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 119.242 -1.456 . . . . 0.0 109.768 169.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' LYS . . . . . 0.436 ' HA ' ' HE3' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -152.21 44.13 0.71 Allowed 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 115.19 -0.505 . . . . 0.0 110.288 173.575 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.795 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.0 OUTLIER 68.66 -6.16 0.88 Allowed 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 173.37 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.653 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -44.79 -59.49 4.05 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 113.72 1.007 . . . . 0.0 113.72 -174.836 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.694 ' HG2' ' HG2' ' B' ' 67' ' ' ARG . 11.9 Cg_exo -73.93 -17.38 22.52 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 122.453 2.102 . . . . 0.0 113.392 -176.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.923 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -91.11 -21.88 20.98 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.73 0.3 . . . . 0.0 110.636 -177.502 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.672 HD21 HD21 ' B' ' 102' ' ' LEU . 10.6 tp -62.34 -29.02 70.16 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.452 0.644 . . . . 0.0 110.885 -179.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.713 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -77.22 -30.24 54.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.782 -179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.45 -7.18 32.19 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -171.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.78 -27.02 57.86 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.807 0.337 . . . . 0.0 111.483 -176.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.15 51.23 2.45 Favored Glycine 0 N--CA 1.447 -0.601 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.306 -174.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 49.7 mt -109.46 142.79 39.96 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.914 0.387 . . . . 0.0 110.201 -178.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.457 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 16.9 t70 -136.1 138.93 28.7 Favored Pre-proline 0 C--N 1.32 -0.692 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.377 178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 48.7 Cg_exo -60.95 16.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.631 2.887 . . . . 0.0 114.549 -175.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.453 ' HG2' ' OD2' ' B' ' 80' ' ' ASP . 0.2 OUTLIER -107.68 -6.38 16.9 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.996 0.427 . . . . 0.0 110.216 174.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.418 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 28.6 mttm -103.86 143.85 27.49 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.986 -175.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.913 ' HG2' HG12 ' B' ' 40' ' ' ILE . 8.4 Cg_endo -83.12 141.01 10.19 Favored 'Trans proline' 0 N--CA 1.449 -1.145 0 C-N-CA 122.98 2.453 . . . . 0.0 111.108 174.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.0 OUTLIER -140.45 146.79 23.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.43 -178.324 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.509 ' CG1' HD21 ' B' ' 34' ' ' LEU . 2.2 p -124.79 140.3 48.39 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 176.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.877 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 4.2 m -107.23 125.51 63.43 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-O 120.885 0.374 . . . . 0.0 110.656 -177.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.928 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.7 t80 -99.85 150.24 22.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.354 -178.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . 0.634 ' SG ' ' HG3' ' B' ' 46' ' ' ARG . 0.1 OUTLIER 75.26 67.68 0.08 Allowed 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.459 0.647 . . . . 0.0 111.701 -179.376 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.509 ' HA ' ' H ' ' B' ' 95' ' ' ALA . 0.3 OUTLIER -84.15 -1.78 55.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.366 178.021 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' THR . . . . . 0.508 ' HB ' ' H ' ' B' ' 92' ' ' ALA . 0.0 OUTLIER -77.25 -109.09 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.956 -175.091 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.612 ' HA ' ' O ' ' A' ' 68' ' ' GLY . . . -63.9 -46.04 86.65 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -175.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.17 -27.73 64.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.835 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.99 71.02 0.55 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.305 -0.862 . . . . 0.0 111.85 177.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.877 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -65.22 -11.21 38.49 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.141 176.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.34 -32.69 66.98 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.145 177.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -71.35 -27.9 63.69 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-O 121.079 0.466 . . . . 0.0 110.81 178.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' ALA . . . . . 0.415 ' HB1' HD22 ' B' ' 70' ' ' LEU . . . -73.47 -44.58 57.64 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.931 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -87.05 -40.93 6.84 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.543 -0.837 . . . . 0.0 113.782 -174.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 100' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -66.6 -29.54 69.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.004 0.402 . . . . 0.0 111.295 -174.883 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . 0.473 ' HA ' ' HG3' ' B' ' 104' ' ' GLU . 8.0 m -72.74 -35.66 67.57 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.939 0.4 . . . . 0.0 111.127 176.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.672 HD21 HD21 ' B' ' 74' ' ' LEU . 11.2 mt -66.61 -37.01 83.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -176.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.574 ' HD3' ' O ' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -67.03 -25.07 66.09 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 120.773 0.32 . . . . 0.0 110.675 179.194 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.473 ' HG3' ' HA ' ' B' ' 101' ' ' THR . 2.5 mt-10 -68.73 -6.6 27.36 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.23 174.696 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . 0.489 ' CE1' ' HB ' ' A' ' 10' ' ' THR . 17.2 m-85 -110.18 -11.2 14.61 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.68 0.276 . . . . 0.0 110.744 177.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 97.75 60.47 0.93 Allowed Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.349 -0.929 . . . . 0.0 113.2 174.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' PHE . . . . . 0.532 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.1 m-85 -92.46 158.16 16.18 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 122.745 -0.268 . . . . 0.0 110.291 176.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 8.4 tttm -61.26 -70.27 0.19 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.535 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.6 113.97 9.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.837 178.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.3 tt -113.06 123.5 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.625 0.726 . . . . 0.0 110.936 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' TYR . . . . . 0.415 ' O ' ' HA ' ' B' ' 86' ' ' VAL . 1.3 m-85 -113.99 146.81 39.63 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.271 -176.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.404 ' OD1' ' HB3' ' B' ' 90' ' ' LYS . 24.3 t-20 -111.33 138.67 47.52 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 172.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.496 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 8.4 m -87.57 111.84 21.64 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 120.982 0.42 . . . . 0.0 112.038 -174.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.408 ' HG2' ' SD ' ' B' ' 24' ' ' MET . 0.8 OUTLIER -63.21 148.28 48.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.253 177.081 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 85.38 -109.23 3.29 Favored Glycine 0 N--CA 1.442 -0.95 0 C-N-CA 120.621 -0.8 . . . . 0.0 111.175 -174.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . 0.588 ' HA3' ' S5 ' ' B' ' 139' ' ' PS5 . . . 162.57 -157.77 29.79 Favored Glycine 0 N--CA 1.446 -0.694 0 N-CA-C 111.152 -0.779 . . . . 0.0 111.152 178.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 117' ' ' MET . . . . . 0.453 ' HB3' ' S3 ' ' B' ' 139' ' ' PS5 . 3.0 tmm? -60.6 -33.89 73.41 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.122 0.486 . . . . 0.0 110.144 177.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.585 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.52 -34.5 74.2 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.854 179.294 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 119' ' ' LYS . . . . . 0.418 ' O ' ' HB2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -72.74 -32.38 65.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.535 0.207 . . . . 0.0 111.384 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.759 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 20.2 t-105 -64.39 -54.63 29.78 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 50.2 mt -62.84 -43.41 98.86 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.499 0.19 . . . . 0.0 111.163 179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.585 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.6 OUTLIER -63.09 -33.08 74.69 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.898 -176.252 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . 0.599 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.3 OUTLIER -82.96 -3.91 57.67 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.992 -177.28 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.18 27.75 73.6 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.823 -0.703 . . . . 0.0 111.672 -178.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.599 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 70.1 mt -72.47 161.97 76.36 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.654 -0.273 . . . . 0.0 110.283 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.597 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 21.8 Cg_endo -57.21 108.68 0.38 Allowed 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.851 2.367 . . . . 0.0 111.642 178.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -129.63 149.99 51.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 2.7 mt -103.15 101.2 11.15 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 174.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -135.36 143.61 46.19 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.841 -0.618 . . . . 0.0 109.868 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 130' ' ' ARG . . . . . 0.448 ' O ' ' HD2' ' B' ' 132' ' ' HIS . 8.0 ttt180 -91.84 103.15 15.73 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 179.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -52.61 125.95 18.14 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.715 -178.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 132' ' ' HIS . . . . . 0.448 ' HD2' ' O ' ' B' ' 130' ' ' ARG . 24.7 m170 -75.45 54.28 0.73 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.542 -175.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -88.82 60.62 5.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.129 0.49 . . . . 0.0 111.377 -177.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -151.87 29.75 0.59 Allowed 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.321 174.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -139.45 117.17 11.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.628 -178.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 49.0 p-80 -127.98 -5.01 5.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.249 0.547 . . . . 0.0 109.818 176.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 . . . . . 0 C--O 1.248 1.025 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.186 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' PS5 . . . . . 0.467 ' S5 ' ' HB ' ' A' ' 91' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 139' ' ' PS5 . . . . . 0.588 ' S5 ' ' HA3' ' B' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.933 0 CA-C-O 120.652 0.263 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -83.8 45.1 1.04 Allowed 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -175.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.1 mmt -76.57 -13.71 60.06 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 173.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.659 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -52.16 -26.57 20.92 Favored Glycine 0 N--CA 1.45 -0.377 0 CA-C-N 114.39 -1.277 . . . . 0.0 113.214 -179.195 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.99 -33.27 57.62 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.541 0.2 . . . . 0.0 111.541 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.542 ' HG3' ' N ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -61.29 -46.57 89.79 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.33 -0.395 . . . . 0.0 112.001 -174.845 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.659 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 1.8 p90 -91.52 -20.51 21.63 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.714 -0.394 . . . . 0.0 111.821 -176.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -53.51 -50.57 65.13 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.786 0.326 . . . . 0.0 110.911 -177.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.71 -32.11 73.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.513 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.03 -42.68 72.61 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.495 178.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.608 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.1 OUTLIER -56.82 -38.27 72.36 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.144 0.497 . . . . 0.0 110.152 176.435 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.72 -32.17 73.57 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.652 177.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -76.32 -45.33 32.74 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.763 -179.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -68.86 -51.45 40.25 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.657 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.44 HG11 ' CD ' ' B' ' 69' ' ' LYS . 22.3 t -61.97 -34.13 61.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.945 -176.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.9 mttm -58.7 -35.24 72.32 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.552 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.19 -28.99 69.78 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.855 0.36 . . . . 0.0 111.217 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -74.7 -31.75 61.96 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.622 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.54 ' HG3' ' SD ' ' A' ' 24' ' ' MET . 0.6 OUTLIER -76.9 -24.02 52.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.664 0.745 . . . . 0.0 110.119 173.74 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.9 -17.4 53.21 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.676 -178.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.602 ' HB3' ' HB2' ' A' ' 100' ' ' LYS . 0.4 OUTLIER -86.58 19.04 3.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -175.634 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.443 ' SD ' ' HA ' ' A' ' 96' ' ' ALA . 0.1 OUTLIER -149.35 157.68 43.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.537 178.197 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -75.7 103.05 3.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.4 . . . . 0.0 110.179 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.574 ' SD ' ' HG2' ' A' ' 114' ' ' GLU . 1.4 mmt -72.07 125.9 28.42 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.693 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -141.65 152.58 44.07 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.322 -178.033 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.96 139.8 37.13 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.774 179.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.5 Cg_endo -50.46 -19.38 4.72 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.578 2.852 . . . . 0.0 113.982 -177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -46.01 51.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.848 0.356 . . . . 0.0 111.066 176.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.49 ' HA ' ' HG2' ' A' ' 32' ' ' LYS . 1.2 t70 -77.39 -29.32 53.11 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 120.971 0.415 . . . . 0.0 110.458 178.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.94 -36.25 77.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.43 176.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . . 60.6 t80 -74.38 -39.76 62.52 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.777 -177.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.49 ' HG2' ' HA ' ' A' ' 29' ' ' ASP . 2.4 pttt -63.08 -41.08 99.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 120.98 -0.288 . . . . 0.0 111.592 -174.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.536 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -74.19 -26.19 60.13 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.764 0.316 . . . . 0.0 110.612 176.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.698 HD11 ' HB2' ' A' ' 42' ' ' LEU . 4.6 mt -61.16 -54.43 44.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.408 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.3 mm-40 -75.8 -28.32 58.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.547 -175.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.528 ' HG2' ' HA ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -84.6 -22.65 29.92 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.825 0.345 . . . . 0.0 111.158 -176.166 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 -121.05 106.83 38.37 Favored Pre-proline 0 C--N 1.324 -0.528 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.209 178.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.541 ' HA ' HD21 ' A' ' 61' ' ' ASN . 14.0 Cg_exo -67.69 -0.94 5.89 Favored 'Trans proline' 0 CA--C 1.531 0.364 0 C-N-CA 122.817 2.345 . . . . 0.0 112.288 178.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -96.49 -25.33 15.7 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.066 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.624 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 53.6 mt -84.84 111.5 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.067 176.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.728 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -106.71 144.91 32.68 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.967 -176.647 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 1.0 HD11 ' HB2' ' A' ' 88' ' ' PHE . 25.8 tp -101.94 125.97 48.74 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 175.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.464 ' HA ' ' O ' ' A' ' 63' ' ' LYS . 4.1 mt -108.96 106.24 20.33 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-N 115.617 -0.72 . . . . 0.0 109.176 174.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.784 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 3.6 t0 -83.2 125.18 31.28 Favored 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 178.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.674 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.6 OUTLIER -110.31 97.19 5.41 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.876 0 CA-C-O 121.603 0.716 . . . . 0.0 109.122 -178.731 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.55 ' HD2' ' SD ' ' A' ' 117' ' ' MET . 0.0 OUTLIER -162.51 -164.27 1.0 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 114.412 -1.267 . . . . 0.0 108.405 -176.0 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.484 ' CG ' HH12 ' B' ' 46' ' ' ARG . 11.7 m-20 -119.92 143.87 36.18 Favored Pre-proline 0 C--N 1.325 -0.472 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -177.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -65.68 -24.34 55.3 Favored 'Trans proline' 0 CA--C 1.529 0.242 0 C-N-CA 123.064 2.509 . . . . 0.0 114.194 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.82 -48.06 34.09 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.577 -0.449 . . . . 0.0 111.359 -176.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -70.07 -27.35 64.56 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.137 174.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.28 -43.3 99.1 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.943 173.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.4 mtpt -59.97 -35.95 76.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.578 178.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.15 -37.31 23.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.336 -175.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.3 mmm -100.47 -34.4 9.95 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.183 0.438 . . . . 0.0 112.183 -173.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 119.19 169.01 14.2 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 121.138 -0.553 . . . . 0.0 112.059 -178.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.475 ' HG3' ' HB2' ' A' ' 128' ' ' LEU . 6.2 pttt -138.3 158.07 71.44 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.436 ' HB3' ' CZ2' ' A' ' 120' ' ' TRP . 19.8 Cg_exo -68.2 133.87 29.86 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.315 2.01 . . . . 0.0 113.137 -176.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.638 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 21.3 t0 -97.13 86.42 3.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.759 176.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.584 HG22 ' HB2' ' A' ' 62' ' ' TYR . 6.5 m -133.28 159.66 42.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.307 -179.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.73 -41.5 99.21 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.928 -175.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.541 HD21 ' HA ' ' A' ' 38' ' ' PRO . 0.4 OUTLIER -116.99 84.34 2.13 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.902 0.382 . . . . 0.0 110.737 -177.302 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.784 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 5.8 t80 -125.51 126.94 45.66 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.401 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.728 ' HE2' HG21 ' A' ' 41' ' ' THR . 8.5 mttm -127.34 126.88 43.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.231 178.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -96.59 120.96 37.86 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.503 0.192 . . . . 0.0 110.668 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.738 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.1 OUTLIER -118.87 104.92 10.99 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 177.783 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.427 ' HB3' ' O ' ' A' ' 46' ' ' ARG . 0.9 OUTLIER -130.67 179.83 5.72 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -171.547 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.485 ' C ' ' H ' ' A' ' 69' ' ' LYS . 6.6 ttp180 60.38 -96.25 0.06 Allowed 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.834 176.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.437 ' H ' ' HB3' ' A' ' 67' ' ' ARG . . . -55.46 17.13 0.01 OUTLIER Glycine 0 CA--C 1.526 0.744 0 N-CA-C 116.642 1.417 . . . . 0.0 116.642 -166.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.633 ' HD3' ' HB3' ' B' ' 92' ' ' ALA . 1.4 mtmp? 82.25 16.41 0.41 Allowed 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 123.852 0.861 . . . . 0.0 108.812 -175.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.738 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.1 OUTLIER 71.16 -26.52 0.17 Allowed 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 113.947 -1.479 . . . . 0.0 112.483 -178.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.702 ' HG3' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -53.51 -42.76 93.58 Favored Pre-proline 0 CA--C 1.545 0.754 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -174.455 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.702 ' HD3' ' HG3' ' A' ' 71' ' ' GLU . 9.7 Cg_exo -71.95 -18.06 28.13 Favored 'Trans proline' 0 C--N 1.358 1.065 0 C-N-CA 121.573 1.516 . . . . 0.0 111.856 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.445 HD22 ' HA ' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -97.6 -21.81 16.85 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.81 -176.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.677 HD21 HD21 ' A' ' 102' ' ' LEU . 15.3 tp -55.14 -56.63 17.77 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.971 -177.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.33 -19.91 64.7 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.039 -175.111 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.1 mmtt -85.2 -12.26 53.07 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.51 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 20.3 m -105.42 35.9 2.69 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -173.098 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.04 56.98 5.0 Favored Glycine 0 C--N 1.335 0.474 0 O-C-N 123.365 0.415 . . . . 0.0 113.526 174.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.522 ' HA ' HD23 ' A' ' 79' ' ' LEU . 4.6 mt -109.19 140.98 42.09 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.769 0.319 . . . . 0.0 110.79 -178.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -136.55 154.64 76.89 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 176.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -68.74 2.67 2.79 Favored 'Trans proline' 0 CA--C 1.529 0.231 0 C-N-CA 122.802 2.335 . . . . 0.0 113.752 -175.331 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.9 26.09 10.51 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.368 0.604 . . . . 0.0 110.176 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 83' ' ' LYS . 5.8 mmtm -107.26 115.94 58.97 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.02 -178.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.624 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 5.8 Cg_exo -74.06 103.75 1.72 Allowed 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.574 2.182 . . . . 0.0 109.951 173.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.546 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 15.6 m -123.16 154.91 28.98 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.468 0.652 . . . . 0.0 111.79 -171.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.447 ' O ' HD12 ' A' ' 42' ' ' LEU . 1.4 p -122.68 145.48 29.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-N 115.247 -0.888 . . . . 0.0 108.766 174.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 43' ' ' ILE . 5.2 m -110.1 129.78 64.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 1.0 ' HB2' HD11 ' A' ' 42' ' ' LEU . 5.2 t80 -104.87 133.66 49.3 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.797 -0.361 . . . . 0.0 111.176 -175.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' CYS . . . . . 0.524 ' SG ' ' HB3' ' A' ' 93' ' ' ALA . 35.5 t 173.11 175.69 0.11 Allowed 'General case' 0 C--O 1.234 0.283 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 -177.469 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.812 ' HA ' ' HA2' ' A' ' 116' ' ' GLY . 0.0 OUTLIER -55.59 -61.4 2.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.938 0.399 . . . . 0.0 110.381 178.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -165.55 -101.37 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.299 176.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.452 ' HA ' ' HB2' ' A' ' 96' ' ' ALA . . . -95.93 27.42 3.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.132 0.491 . . . . 0.0 111.171 179.123 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.524 ' HB3' ' SG ' ' A' ' 89' ' ' CYS . . . -74.72 -54.06 8.08 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.487 179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.665 HH12 ' HB1' ' B' ' 93' ' ' ALA . 0.1 OUTLIER -136.99 -46.1 0.58 Allowed 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.114 179.684 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.674 ' HA ' HG21 ' A' ' 45' ' ' VAL . . . -54.69 -35.8 63.98 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -174.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.452 ' HB2' ' HA ' ' A' ' 92' ' ' ALA . . . -57.1 -36.94 71.23 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -68.73 -35.33 77.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.525 0.202 . . . . 0.0 111.175 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.474 ' HB2' HD22 ' A' ' 70' ' ' LEU . . . -75.01 -53.44 8.92 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.124 0.488 . . . . 0.0 110.926 179.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -66.44 -53.97 25.77 Favored Glycine 0 N--CA 1.451 -0.33 0 CA-C-N 115.643 -0.708 . . . . 0.0 113.719 -175.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.602 ' HB2' ' HB3' ' A' ' 21' ' ' ASP . 0.1 OUTLIER -62.88 -37.33 86.46 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.682 0.277 . . . . 0.0 111.176 -173.192 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.529 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 11.0 m -72.43 -39.52 67.8 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 -179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.677 HD21 HD21 ' A' ' 74' ' ' LEU . 11.7 mt -64.83 -47.7 77.02 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.689 0.28 . . . . 0.0 111.422 -179.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.813 ' HA ' ' HB2' ' A' ' 107' ' ' PHE . 1.7 ptm180 -63.6 -27.08 68.99 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.102 0.477 . . . . 0.0 110.734 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -69.73 -5.42 25.02 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.49 -0.777 . . . . 0.0 112.232 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 -110.68 -6.64 14.78 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 121.005 -0.278 . . . . 0.0 111.197 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.56 31.62 1.12 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.175 -1.012 . . . . 0.0 112.919 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.813 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 2.3 m-85 -81.56 142.5 32.77 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.989 -0.375 . . . . 0.0 109.989 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.436 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.1 tttt -62.88 -87.25 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.445 -176.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.436 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -116.45 120.88 40.18 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.371 -177.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.546 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 0.5 OUTLIER -125.52 129.42 72.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.25 0.548 . . . . 0.0 110.554 -178.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -118.6 154.55 32.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.327 -176.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -131.27 158.49 40.47 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 172.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.1 OUTLIER -82.09 139.14 34.59 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.113 0.482 . . . . 0.0 111.478 -176.31 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.574 ' HG2' ' SD ' ' A' ' 24' ' ' MET . 0.0 OUTLIER -99.68 18.81 17.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 176.595 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.76 -75.73 0.16 Allowed Glycine 0 N--CA 1.445 -0.736 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.928 -179.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.812 ' HA2' ' HA ' ' A' ' 90' ' ' LYS . . . 150.34 174.86 21.88 Favored Glycine 0 N--CA 1.444 -0.811 0 C-N-CA 121.014 -0.613 . . . . 0.0 111.96 179.411 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' MET . . . . . 0.55 ' SD ' ' HD2' ' A' ' 46' ' ' ARG . 19.7 ttm -64.9 -36.37 84.15 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.419 0.628 . . . . 0.0 109.753 176.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -64.38 -27.78 69.24 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.044 177.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.404 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -69.37 -32.44 71.48 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-N 116.791 -0.186 . . . . 0.0 111.107 -179.165 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.675 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 27.8 t-105 -56.2 -52.29 64.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 175.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.417 ' HA ' HD23 ' A' ' 121' ' ' LEU . 3.3 mt -66.03 -40.86 91.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.444 178.256 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -68.13 -43.07 79.17 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.725 -175.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 119' ' ' LYS . 65.1 mt-10 -69.69 -18.12 63.52 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.763 0.316 . . . . 0.0 110.816 -178.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 93.65 25.04 19.21 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.488 176.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 97.2 mt -80.45 152.46 73.05 Favored Pre-proline 0 C--N 1.323 -0.559 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 -179.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.638 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 13.8 Cg_endo -56.32 120.89 9.06 Favored 'Trans proline' 0 C--O 1.235 0.357 0 C-N-CA 123.154 2.569 . . . . 0.0 112.286 -178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.63 157.29 45.15 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.469 -177.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.475 ' HB2' ' HG3' ' A' ' 56' ' ' LYS . 2.9 mt -110.62 101.66 10.3 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.09 178.452 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -132.49 132.72 42.97 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.63 -50.38 0.62 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.195 0.598 . . . . 0.0 111.9 -178.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.4 m 62.28 81.61 0.19 Allowed 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.215 0.606 . . . . 0.0 110.679 -179.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -64.35 -57.26 9.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.455 -177.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -166.2 127.23 1.77 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.008 177.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -110.72 -23.09 11.25 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.071 0.462 . . . . 0.0 110.148 179.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -136.46 146.03 45.87 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.016 177.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -109.76 -13.29 14.51 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.598 0.713 . . . . 0.0 109.405 177.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 . . . . . 0 C--O 1.248 0.999 0 CA-C-O 117.645 -1.169 . . . . 0.0 108.327 -179.595 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.779 0.323 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -150.76 -36.23 0.14 Allowed 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.989 0.423 . . . . 0.0 110.709 -179.342 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.65 -3.07 55.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.918 -179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.67 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -56.46 -27.07 53.25 Favored Glycine 0 CA--C 1.52 0.393 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.469 179.267 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -74.61 -33.92 62.72 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.014 0.435 . . . . 0.0 110.892 176.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.498 ' HG3' ' N ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -64.59 -47.05 80.07 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.872 -174.793 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.67 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 11.8 p90 -84.44 -24.26 29.6 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 120.223 -0.591 . . . . 0.0 111.38 -177.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.85 -48.37 70.04 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.788 -178.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.23 -43.61 98.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.407 179.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.57 -43.09 99.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.736 178.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' PHE . . . . . 0.566 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 2.1 t80 -56.48 -41.24 76.26 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.292 0.568 . . . . 0.0 110.339 178.698 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' LYS . . . . . 0.653 ' HD2' ' HB2' ' A' ' 71' ' ' GLU . 0.6 OUTLIER -65.87 -26.97 67.88 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.347 -0.842 . . . . 0.0 111.756 179.361 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.81 -40.57 61.01 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.075 178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -71.28 -50.43 32.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.317 179.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -60.77 -33.45 55.21 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.146 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.6 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -66.79 -40.19 88.06 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.794 0.33 . . . . 0.0 111.268 178.026 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.54 -26.32 68.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.447 -178.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.58 -49.8 71.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.6 -178.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.36 -21.35 58.41 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.03 0.443 . . . . 0.0 111.092 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.0 -19.65 62.5 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.33 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.403 ' OD1' ' HD3' ' B' ' 103' ' ' ARG . 2.6 t70 -78.42 -9.26 59.22 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.953 0.406 . . . . 0.0 111.345 -178.269 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.588 ' HE1' ' HA3' ' B' ' 99' ' ' GLY . 11.8 mtp -116.93 165.7 13.03 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 122.212 -0.305 . . . . 0.0 110.998 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 42.7 t -73.53 111.22 8.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 174.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' MET . . . . . 0.685 ' HB3' ' HG3' ' B' ' 114' ' ' GLU . 0.7 OUTLIER -78.67 105.43 9.95 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.869 -175.109 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' B' ' 25' ' ' LEU . 0.5 OUTLIER -121.78 148.26 44.89 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.505 0.669 . . . . 0.0 111.333 -177.039 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.99 137.05 33.37 Favored Pre-proline 0 C--N 1.317 -0.842 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.207 -179.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -41.09 -31.65 0.86 Allowed 'Trans proline' 0 CA--C 1.537 0.652 0 C-N-CA 124.632 3.555 . . . . 0.0 115.388 -175.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.647 ' HG3' ' OE1' ' B' ' 123' ' ' GLU . 13.5 mtmm -73.43 -40.86 63.9 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 118.41 0.55 . . . . 0.0 110.738 178.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 55.5 m-20 -69.66 -34.91 74.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.151 177.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.1 -43.27 78.87 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.006 -0.997 . . . . 0.0 110.362 176.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' TYR . . . . . 0.437 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 73.2 t80 -67.07 -31.09 71.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.765 -0.652 . . . . 0.0 111.327 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 11.9 tptt -61.58 -52.73 63.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.825 -179.52 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.533 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -72.26 -26.62 62.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 179.755 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.664 HD11 ' HB2' ' B' ' 42' ' ' LEU . 5.1 mt -59.55 -55.39 35.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.649 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 9.0 mm100 -74.1 -32.88 63.4 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.174 -175.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -71.98 -40.67 68.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.259 -176.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -108.5 113.61 59.93 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.371 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -69.45 -3.61 12.16 Favored 'Trans proline' 0 C--O 1.234 0.311 0 C-N-CA 122.873 2.382 . . . . 0.0 112.913 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -103.89 -16.64 15.3 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.538 -178.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.533 HD12 ' HB2' ' B' ' 33' ' ' LEU . 16.3 mt -81.12 109.02 15.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 CA-C-O 121.25 0.548 . . . . 0.0 109.927 176.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.673 HG21 ' HE2' ' B' ' 63' ' ' LYS . 97.0 m -97.68 142.59 29.29 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.262 -176.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.867 HD11 ' HB2' ' B' ' 88' ' ' PHE . 11.3 tp -103.8 126.45 50.94 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 169.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.6 mp -105.85 118.98 54.38 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 178.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.793 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -95.16 126.45 40.5 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 178.619 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -115.63 97.77 6.01 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.677 -178.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . 0.484 HH12 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -168.48 179.92 4.16 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.558 -177.738 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -98.68 154.79 37.3 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.237 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -69.28 -19.19 38.74 Favored 'Trans proline' 0 CA--C 1.529 0.247 0 C-N-CA 122.736 2.291 . . . . 0.0 113.452 -176.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.0 -45.43 23.77 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.187 -0.205 . . . . 0.0 111.484 -178.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -73.06 -30.63 63.84 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 175.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.67 -46.53 88.77 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.751 175.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.57 -31.83 71.88 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.044 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -85.06 -37.24 20.56 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -176.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 5.5 mtm -98.93 -19.51 17.29 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -172.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 98.77 165.62 30.47 Favored Glycine 0 N--CA 1.439 -1.126 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.729 -175.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 2.7 pttt -143.58 145.01 29.71 Favored Pre-proline 0 C--N 1.323 -0.556 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.458 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 13.8 Cg_endo -61.57 135.55 57.6 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 122.846 2.364 . . . . 0.0 112.724 -177.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -112.32 84.24 1.94 Allowed 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.378 178.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.488 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.5 m -121.69 167.22 15.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.381 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 mttm -60.43 -47.9 84.08 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -174.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -115.72 71.06 0.76 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.143 0.496 . . . . 0.0 110.906 -177.475 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.793 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.7 OUTLIER -114.92 131.59 56.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 177.239 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.673 ' HE2' HG21 ' B' ' 41' ' ' THR . 1.0 OUTLIER -133.8 126.84 31.44 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.261 0.553 . . . . 0.0 110.313 179.018 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 20.0 t-80 -82.16 122.16 27.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.79 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' MET . . . . . 0.808 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.7 OUTLIER -139.79 100.43 3.95 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.223 -177.673 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -149.98 -161.87 1.43 Allowed 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 121.162 -0.215 . . . . 0.0 111.481 -176.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' ARG . . . . . 0.581 ' C ' ' H ' ' B' ' 69' ' ' LYS . 0.2 OUTLIER 61.32 -95.74 0.05 Allowed 'General case' 0 N--CA 1.47 0.537 0 O-C-N 123.871 0.732 . . . . 0.0 111.464 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . 0.41 ' H ' ' HB3' ' B' ' 67' ' ' ARG . . . -57.86 18.31 0.02 OUTLIER Glycine 0 C--N 1.339 0.702 0 C-N-CA 123.937 0.779 . . . . 0.0 114.96 -171.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' LYS . . . . . 0.581 ' H ' ' C ' ' B' ' 67' ' ' ARG . 1.1 mtmp? 81.9 16.4 0.45 Allowed 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 124.367 1.067 . . . . 0.0 108.86 -174.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.596 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.3 OUTLIER 64.36 -26.54 0.08 Allowed 'General case' 0 C--N 1.346 0.455 0 C-N-CA 125.039 1.336 . . . . 0.0 113.365 175.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.475 ' H ' ' HG3' ' B' ' 71' ' ' GLU . 0.0 OUTLIER -50.2 -46.55 83.03 Favored Pre-proline 0 N--CA 1.474 0.755 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -175.483 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.459 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 34.1 Cg_exo -61.24 -18.55 59.29 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 121.969 1.779 . . . . 0.0 112.454 -179.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.808 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -105.68 -21.14 13.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.144 0.497 . . . . 0.0 110.52 179.5 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.577 HD21 HD21 ' B' ' 102' ' ' LEU . 9.7 tp -64.36 -33.32 75.57 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.536 179.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -78.65 -24.29 45.27 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.81 177.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 35.1 mtpt -86.69 -2.53 58.6 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -175.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' SER . . . . . 0.594 ' HB3' ' HD2' ' B' ' 63' ' ' LYS . 20.1 m -116.55 35.59 4.5 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -172.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 38.44 56.25 1.97 Allowed Glycine 0 C--N 1.338 0.661 0 O-C-N 123.626 0.579 . . . . 0.0 114.151 173.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 73.6 mt -103.25 140.04 37.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.791 0.329 . . . . 0.0 110.542 -178.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.651 ' HB2' ' HG3' ' B' ' 83' ' ' LYS . 11.0 m-20 -126.06 140.71 37.59 Favored Pre-proline 0 C--N 1.322 -0.598 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.534 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 38.6 Cg_endo -66.16 6.34 0.52 Allowed 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 122.812 2.342 . . . . 0.0 113.162 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.491 ' H ' ' HG3' ' B' ' 82' ' ' GLU . 0.9 OUTLIER -105.87 -7.02 18.47 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.942 0.401 . . . . 0.0 110.727 176.55 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.651 ' HG3' ' HB2' ' B' ' 80' ' ' ASP . 3.0 mttp -96.13 133.22 25.42 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.837 -179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.486 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.9 Cg_exo -72.56 123.04 8.76 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 122.645 2.23 . . . . 0.0 111.382 176.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 25.6 m -128.5 155.53 40.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-O 120.85 0.357 . . . . 0.0 110.717 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.529 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 1.4 p -129.99 144.04 39.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 178.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 12.0 m -105.83 129.31 59.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.895 0.378 . . . . 0.0 110.433 -179.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.867 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.3 t80 -105.84 130.04 53.89 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.666 -179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . 0.663 ' HB3' ' HB2' ' B' ' 95' ' ' ALA . 0.0 OUTLIER 156.66 170.28 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.393 0 O-C-N 125.194 1.559 . . . . 0.0 107.087 -177.589 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.504 ' N ' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -61.36 121.79 13.53 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 177.375 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' THR . . . . . 0.614 HG22 ' HE1' ' B' ' 24' ' ' MET . 0.2 OUTLIER -11.93 -82.21 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 115.02 1.489 . . . . 0.0 115.02 -174.833 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.633 ' HB3' ' HD3' ' A' ' 69' ' ' LYS . . . -104.51 20.72 18.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.946 -175.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.665 ' HB1' HH12 ' A' ' 94' ' ' ARG . . . -75.59 -36.77 60.23 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.844 0.354 . . . . 0.0 110.969 178.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -169.69 -29.91 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.675 178.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.663 ' HB2' ' HB3' ' B' ' 89' ' ' CYS . . . -59.11 -37.34 76.95 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.31 -178.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.01 -36.59 75.19 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.255 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -68.22 -30.79 69.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.028 178.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.68 -38.39 54.53 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.707 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 99' ' ' GLY . . . . . 0.588 ' HA3' ' HE1' ' B' ' 22' ' ' MET . . . -96.61 -41.85 3.52 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.292 -0.956 . . . . 0.0 113.939 -171.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -24.6 67.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.011 0.434 . . . . 0.0 110.867 -176.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.86 -53.94 11.66 Favored 'General case' 0 N--CA 1.436 -1.131 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.574 176.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.577 HD21 HD21 ' B' ' 74' ' ' LEU . 32.2 mt -55.28 -44.6 75.84 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.081 -0.963 . . . . 0.0 111.797 -175.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.595 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.0 OUTLIER -64.96 -31.17 72.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.898 0.38 . . . . 0.0 110.811 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -75.52 -6.71 51.57 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.222 176.113 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . 0.608 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 16.5 m-30 -99.91 -11.36 20.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.953 0.406 . . . . 0.0 110.132 177.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.09 25.75 2.2 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.096 174.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' PHE . . . . . 0.595 ' HB2' ' HA ' ' B' ' 103' ' ' ARG . 2.3 m-85 -76.09 152.0 36.91 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.735 0.302 . . . . 0.0 110.661 179.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -75.55 -77.7 0.12 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.335 -175.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -124.39 109.31 13.15 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.005 0.431 . . . . 0.0 110.931 -178.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' ILE . . . . . 0.457 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.8 tt -114.57 129.68 70.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.587 -177.293 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' TYR . . . . . 0.529 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 4.1 m-85 -113.37 143.72 44.0 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.056 -174.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.58 ' HB3' ' HE3' ' B' ' 24' ' ' MET . 19.5 t-20 -113.68 140.3 48.35 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 173.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.444 ' OG ' ' HD1' ' B' ' 88' ' ' PHE . 15.7 m -83.01 108.32 16.23 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.816 0.341 . . . . 0.0 111.634 -176.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.685 ' HG3' ' HB3' ' B' ' 24' ' ' MET . 0.5 OUTLIER -71.99 30.16 0.05 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.645 -176.012 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . 0.555 ' HA3' ' HG2' ' B' ' 119' ' ' LYS . . . -145.1 -73.83 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.28 178.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 135.01 -177.63 19.17 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.675 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.89 -32.57 72.02 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.207 0.527 . . . . 0.0 110.812 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.457 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 30.0 p-10 -66.24 -28.85 69.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.936 179.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 119' ' ' LYS . . . . . 0.555 ' HG2' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -74.11 -33.21 63.52 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.301 179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.772 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 19.3 t-105 -58.93 -49.91 76.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.913 0.387 . . . . 0.0 110.314 178.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 4.1 mt -68.67 -36.86 79.08 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.972 177.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.457 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.7 OUTLIER -68.32 -44.53 75.19 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -176.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . 0.647 ' OE1' ' HG3' ' B' ' 28' ' ' LYS . 68.1 mt-10 -80.1 8.61 6.84 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.801 0.334 . . . . 0.0 111.172 -176.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.58 21.36 77.28 Favored Glycine 0 N--CA 1.451 -0.311 0 CA-C-N 115.707 -0.679 . . . . 0.0 113.245 172.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.479 HD21 ' HG2' ' B' ' 28' ' ' LYS . 96.0 mt -79.75 158.92 72.52 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-O 120.708 0.289 . . . . 0.0 111.001 -178.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.438 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 41.5 Cg_endo -65.51 107.8 1.09 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 122.878 2.385 . . . . 0.0 112.326 -178.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -124.84 150.39 46.46 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.017 -0.735 . . . . 0.0 109.017 175.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.86 100.75 4.89 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 178.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -135.81 92.79 2.86 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.881 -175.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.85 -88.8 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.321 -0.854 . . . . 0.0 112.428 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.7 m 62.04 -108.55 0.3 Allowed 'General case' 0 CA--C 1.529 0.142 0 C-N-CA 122.892 0.477 . . . . 0.0 110.516 -179.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 132' ' ' HIS . . . . . 0.453 ' HB3' ' H ' ' B' ' 133' ' ' HIS . 0.1 OUTLIER -169.37 -104.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.795 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 133' ' ' HIS . . . . . 0.453 ' H ' ' HB3' ' B' ' 132' ' ' HIS . 0.8 OUTLIER -144.13 156.18 44.23 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 177.424 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -112.5 16.79 19.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.977 0.418 . . . . 0.0 110.272 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 -132.99 90.57 2.77 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.087 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -92.64 40.18 1.05 Allowed 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.328 0.585 . . . . 0.0 109.853 177.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 . . . . . 0 C--O 1.254 1.295 0 CA-C-O 117.634 -1.174 . . . . 0.0 108.317 179.576 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 139' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 120.606 0.241 . . . . 0.0 111.129 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -170.23 39.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.448 0.642 . . . . 0.0 109.909 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.434 ' HB2' ' HD2' ' B' ' 81' ' ' PRO . 1.4 mpp? -90.88 8.06 36.9 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.55 -177.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.774 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -59.65 -39.41 95.13 Favored Glycine 0 C--O 1.226 -0.395 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.748 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.79 -39.47 91.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.045 0.45 . . . . 0.0 110.532 177.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.0 mmtm -60.4 -55.78 29.46 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.038 -0.983 . . . . 0.0 112.106 -175.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.918 ' HE2' ' HD3' ' B' ' 81' ' ' PRO . 3.0 p90 -78.97 -22.84 45.04 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 120.274 -0.57 . . . . 0.0 111.71 -176.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.575 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 18.6 t70 -54.31 -45.54 72.62 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 123.476 0.485 . . . . 0.0 110.613 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.76 -42.05 91.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.945 177.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -60.94 -41.72 96.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.069 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.494 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.9 OUTLIER -58.76 -45.73 89.08 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.184 0.516 . . . . 0.0 110.072 178.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -66.04 -27.85 68.41 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.694 178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.46 -39.78 62.3 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.384 -179.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -72.66 -49.06 34.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.693 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.817 HG11 ' HG2' ' B' ' 71' ' ' GLU . 1.4 t -64.14 -34.08 66.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.605 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -67.3 -30.85 70.81 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.588 0.232 . . . . 0.0 111.085 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.84 -25.56 67.6 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.006 0.432 . . . . 0.0 110.904 178.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.6 -29.89 63.89 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.103 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.35 -23.35 50.89 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.196 0.522 . . . . 0.0 110.836 174.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.82 -19.9 36.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.976 -178.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -66.19 -21.9 66.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.672 -0.695 . . . . 0.0 112.155 -175.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.607 ' HG3' ' HB2' ' A' ' 112' ' ' ASN . 0.0 OUTLIER -138.24 -174.88 3.92 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.996 0.427 . . . . 0.0 111.621 -177.527 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.7 t -87.22 112.95 23.93 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.08 -178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -81.48 114.1 19.98 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.44 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 25' ' ' LEU . 0.7 OUTLIER -121.61 143.08 49.52 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.033 -177.25 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 2.0 m -73.97 140.14 77.07 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 115.993 -0.549 . . . . 0.0 109.893 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.407 ' HB3' ' HE3' ' A' ' 120' ' ' TRP . 2.0 Cg_endo -43.28 -36.27 6.11 Favored 'Trans proline' 0 CA--C 1.535 0.541 0 C-N-CA 124.232 3.288 . . . . 0.0 114.773 -175.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.12 -41.26 61.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.927 0.394 . . . . 0.0 111.216 179.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.32 -30.1 70.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.253 177.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.449 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -73.47 -45.69 52.59 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.604 177.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.737 ' HA ' HD12 ' A' ' 34' ' ' LEU . 60.4 t80 -63.38 -31.87 73.15 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.822 0.344 . . . . 0.0 111.097 -179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -56.87 -52.97 63.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.306 -178.649 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.414 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -70.4 -26.51 63.72 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.029 178.56 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.737 HD12 ' HA ' ' A' ' 31' ' ' TYR . 75.1 mt -64.34 -46.64 82.57 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.029 0.442 . . . . 0.0 111.008 178.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.726 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 1.2 pp0? -75.98 -29.51 58.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.572 -175.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -87.63 -25.38 23.58 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.754 0.311 . . . . 0.0 110.847 -177.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 68.7 m-80 -122.53 97.42 44.7 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.74 0.48 4.2 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.021 2.481 . . . . 0.0 112.818 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -95.43 -23.59 17.07 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 176.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.544 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 51.1 mt -80.07 112.38 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.395 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.172 173.015 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.732 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.2 OUTLIER -105.56 145.71 30.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.356 -174.192 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.984 HD11 ' HB2' ' A' ' 88' ' ' PHE . 4.3 tp -102.3 128.24 48.94 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -108.55 117.09 53.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 175.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.842 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.9 OUTLIER -105.4 138.13 42.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.224 -175.226 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -120.67 98.59 6.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.074 175.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.672 ' HD3' ' HG3' ' A' ' 117' ' ' MET . 0.2 OUTLIER -144.62 147.63 33.34 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.331 -176.881 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 1.362 ' CG ' HH11 ' B' ' 46' ' ' ARG . 70.5 m-20 -62.21 136.11 95.34 Favored Pre-proline 0 C--N 1.321 -0.639 0 O-C-N 123.392 0.432 . . . . 0.0 111.086 -177.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -61.6 -31.38 86.94 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.07 2.514 . . . . 0.0 113.1 -177.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -78.37 -36.6 45.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.87 0.367 . . . . 0.0 110.277 178.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.761 ' HB2' ' CG ' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -67.94 -34.53 76.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.36 175.355 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.615 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.2 tp -57.9 -34.59 69.98 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.418 0.628 . . . . 0.0 110.315 176.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.0 mtpt -75.74 -39.1 57.77 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.763 178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.88 -48.25 11.77 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 -173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 mtm -97.54 -36.61 10.25 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.595 -174.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.28 172.79 13.53 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.248 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.615 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.1 OUTLIER -136.11 152.06 74.73 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -61.42 126.04 18.28 Favored 'Trans proline' 0 N--CA 1.464 -0.223 0 C-N-CA 122.088 1.859 . . . . 0.0 112.769 -177.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.614 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 63.5 t0 -87.71 87.93 7.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.607 -0.724 . . . . 0.0 109.283 175.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.96 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.2 OUTLIER -123.27 144.91 31.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.79 179.354 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.726 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.69 -42.14 71.07 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.932 0.396 . . . . 0.0 111.036 -176.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.732 ' HB2' HG23 ' A' ' 41' ' ' THR . 7.3 p30 -114.47 72.97 0.8 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.25 -179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.96 ' HB2' HG23 ' A' ' 59' ' ' VAL . 7.5 t80 -97.47 117.91 32.78 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.474 -178.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.62 ' HE2' HG21 ' A' ' 41' ' ' THR . 6.4 mtmm -117.97 110.83 18.18 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 120.677 -0.409 . . . . 0.0 109.962 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -83.5 116.3 22.48 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.937 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -117.82 93.66 4.23 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.997 0.427 . . . . 0.0 110.989 -174.653 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -95.75 -109.82 0.14 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.87 -0.604 . . . . 0.0 112.184 -174.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.861 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.2 OUTLIER 56.56 -135.07 1.24 Allowed 'General case' 0 N--CA 1.469 0.478 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -171.279 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -90.45 -41.31 5.48 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 119.763 -1.208 . . . . 0.0 111.169 175.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.487 ' HD2' ' HG3' ' B' ' 94' ' ' ARG . 0.5 OUTLIER -157.16 44.13 0.36 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.656 0.265 . . . . 0.0 110.899 176.673 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.937 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 68.19 -12.76 0.31 Allowed 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.085 1.143 . . . . 0.0 114.085 172.594 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.586 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -45.38 -56.52 9.35 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 113.526 0.936 . . . . 0.0 113.526 -174.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.861 ' HG2' ' HG2' ' A' ' 67' ' ' ARG . 11.5 Cg_exo -72.92 -18.32 24.53 Favored 'Trans proline' 0 C--N 1.356 0.969 0 C-N-CA 121.898 1.732 . . . . 0.0 113.026 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.731 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 1.0 OUTLIER -90.44 -16.42 29.03 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.042 0.449 . . . . 0.0 110.384 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.645 HD13 HD11 ' A' ' 70' ' ' LEU . 42.1 tp -68.11 -35.87 78.84 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.134 179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.42 -31.21 53.87 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.329 175.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.632 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 3.0 mttm -70.08 -25.09 63.36 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.912 -176.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.92 -44.74 13.93 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.946 0.403 . . . . 0.0 110.634 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.52 58.0 0.97 Allowed Glycine 0 N--CA 1.446 -0.636 0 C-N-CA 120.776 -0.726 . . . . 0.0 111.598 -176.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.609 ' HB3' ' HZ ' ' A' ' 107' ' ' PHE . 7.4 mt -91.6 145.02 24.94 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.604 0.24 . . . . 0.0 110.467 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -122.15 140.15 31.85 Favored Pre-proline 0 C--N 1.326 -0.413 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -67.37 5.56 0.89 Allowed 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.881 2.388 . . . . 0.0 114.371 -173.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -101.85 -11.41 19.06 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.779 -0.575 . . . . 0.0 110.437 175.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 1.8 mptp? -87.9 119.96 70.66 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.257 -179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.675 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 12.5 Cg_exo -67.68 133.46 29.74 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.683 2.255 . . . . 0.0 111.086 176.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 3.8 m -136.19 155.57 35.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-O 121.047 0.451 . . . . 0.0 111.213 -177.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 2.2 p -124.68 141.86 43.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.269 176.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.822 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 3.6 m -107.95 143.34 18.59 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 179.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.984 ' HB2' HD11 ' A' ' 42' ' ' LEU . 5.7 t80 -123.21 139.2 54.29 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -174.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 4.6 t 84.31 90.94 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.416 1.086 . . . . 0.0 111.974 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.566 ' HA ' ' H ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -101.44 -25.06 14.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.494 178.783 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.639 ' HA ' ' HA2' ' B' ' 68' ' ' GLY . 0.0 OUTLIER -87.73 36.69 0.77 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -174.009 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -167.61 -77.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.938 0.399 . . . . 0.0 110.386 176.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -74.07 -26.6 60.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.76 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.612 HH12 HG13 ' A' ' 15' ' ' VAL . 0.0 OUTLIER 75.89 77.93 0.1 Allowed 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.227 179.658 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.822 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . -58.13 -19.64 34.13 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.335 177.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.4 ' HB3' ' HD2' ' A' ' 94' ' ' ARG . . . -59.41 -34.64 72.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.252 177.792 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -70.21 -32.31 70.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 110.09 -0.337 . . . . 0.0 110.09 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.14 -38.14 61.13 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.644 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.41 -44.8 3.64 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.35 -0.929 . . . . 0.0 113.704 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.426 ' O ' ' HG3' ' A' ' 104' ' ' GLU . 0.0 OUTLIER -61.5 -24.85 66.88 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.8 0.333 . . . . 0.0 110.854 -174.844 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.0 -50.75 26.1 Favored 'General case' 0 N--CA 1.439 -0.991 0 CA-C-O 121.359 0.599 . . . . 0.0 110.713 175.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.429 ' HA ' HD23 ' A' ' 102' ' ' LEU . 14.5 mt -55.05 -39.51 69.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.95 -173.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.49 -27.65 67.96 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 121.069 -0.252 . . . . 0.0 110.849 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 3.8 mt-10 -76.41 -7.78 55.76 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.024 0.44 . . . . 0.0 110.704 175.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.513 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 13.8 m-85 -103.65 -2.9 25.87 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.144 177.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 125.97 -12.15 7.28 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.232 -0.985 . . . . 0.0 113.685 173.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.609 ' HZ ' ' HB3' ' A' ' 79' ' ' LEU . 23.8 m-85 -59.44 111.8 1.53 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.082 0.467 . . . . 0.0 110.785 -177.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 31.7 mtmt -66.97 -50.86 60.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.366 -171.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.675 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 1.8 m -121.54 101.99 7.96 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.195 0.522 . . . . 0.0 111.312 -174.675 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.3 tt -121.15 130.9 74.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.922 -176.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -112.77 141.76 46.2 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.591 -176.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.607 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 19.6 t-20 -113.09 144.21 43.02 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 174.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.576 ' OG ' ' HA ' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -79.86 130.42 35.3 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-O 121.101 0.477 . . . . 0.0 112.035 -171.055 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -174.71 1.55 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.196 171.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.883 ' HA3' ' HD3' ' A' ' 119' ' ' LYS . . . 45.76 -104.14 0.06 OUTLIER Glycine 0 CA--C 1.518 0.249 0 O-C-N 123.413 0.445 . . . . 0.0 113.576 177.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.458 ' HA3' ' S4 ' ' A' ' 138' ' ' PS5 . . . -177.46 -163.11 28.84 Favored Glycine 0 N--CA 1.444 -0.771 0 N-CA-C 110.556 -1.018 . . . . 0.0 110.556 177.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' MET . . . . . 0.672 ' HG3' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -71.93 -29.39 64.24 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.142 0.496 . . . . 0.0 109.978 176.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -33.56 69.58 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.87 178.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.924 ' HA ' ' HG2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -66.95 -32.05 73.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.612 -179.006 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.689 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 25.8 t-105 -61.54 -54.66 40.25 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 178.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 16.6 mt -63.55 -42.83 98.36 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 120.92 0.391 . . . . 0.0 111.207 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.924 ' HG2' ' HA ' ' A' ' 119' ' ' LYS . 0.0 OUTLIER -70.45 -32.86 70.61 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.492 ' N ' ' HG3' ' A' ' 122' ' ' GLU . 19.0 mm-40 -80.65 3.4 22.15 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.744 0.307 . . . . 0.0 110.967 -178.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.41 25.05 76.13 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.214 178.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.459 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 60.5 mt -74.24 161.7 77.12 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 110.202 -0.296 . . . . 0.0 110.202 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.614 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 35.3 Cg_endo -61.03 115.32 2.63 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.516 2.144 . . . . 0.0 111.385 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.24 150.39 51.94 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.939 -0.393 . . . . 0.0 109.939 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.513 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 5.7 mt -102.92 102.3 12.37 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.059 0.457 . . . . 0.0 110.154 -179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.95 127.23 45.63 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.07 44.92 0.33 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.193 -0.458 . . . . 0.0 112.116 -172.611 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 m 50.12 89.83 0.02 OUTLIER 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.318 0.647 . . . . 0.0 112.232 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -77.72 72.24 4.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.709 175.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.6 t-80 -123.57 -14.31 7.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.704 -173.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -94.17 88.4 5.6 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.08 0.466 . . . . 0.0 110.259 -179.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.46 81.69 0.2 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.493 -178.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -67.19 -30.95 71.03 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 174.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 1.1 t-80 . . . . . 0 C--O 1.251 1.142 0 CA-C-O 117.46 -1.257 . . . . 0.0 108.092 175.133 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.912 0 CA-C-O 120.92 0.391 . . . . 0.0 110.154 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -150.02 117.27 6.03 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.467 176.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' MET . . . . . 0.576 ' HG3' ' HB2' ' B' ' 6' ' ' LYS . 0.0 OUTLIER -115.76 19.2 15.36 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.755 175.46 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.75 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -59.24 -44.57 96.37 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.773 -0.649 . . . . 0.0 113.689 -175.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.98 -32.34 72.68 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.165 0.507 . . . . 0.0 110.888 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.576 ' HB2' ' HG3' ' B' ' 3' ' ' MET . 0.4 OUTLIER -71.55 -52.52 17.73 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.438 -174.491 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.75 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.2 OUTLIER -83.81 -22.85 31.67 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 119.899 -0.72 . . . . 0.0 112.219 -176.185 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -53.24 -45.72 68.87 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.154 0.502 . . . . 0.0 109.989 -178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.26 -39.42 90.31 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.527 176.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.63 -46.74 62.75 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.451 0.167 . . . . 0.0 111.269 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' PHE . . . . . 0.513 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 0.4 OUTLIER -56.67 -43.17 80.13 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.411 0.624 . . . . 0.0 109.947 179.227 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' LYS . . . . . 0.597 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.7 OUTLIER -66.2 -26.39 67.37 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.486 176.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.89 -49.35 20.66 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.892 0.377 . . . . 0.0 111.124 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -62.91 -50.97 68.78 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.129 179.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -66.41 -32.84 59.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.596 -175.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.597 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 6.3 ttmm -66.03 -40.76 91.27 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.583 0.23 . . . . 0.0 110.913 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.66 -27.01 62.47 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.485 -178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.85 -32.54 63.71 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.753 179.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.75 -24.95 41.2 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.462 0.648 . . . . 0.0 110.702 172.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.04 -17.11 36.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.026 -0.988 . . . . 0.0 112.317 -175.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.585 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 8.4 t0 -69.05 -25.96 64.72 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.901 -174.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.63 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 5.8 ptm -119.73 176.68 5.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.847 0.356 . . . . 0.0 111.772 -176.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 41.2 t -74.17 111.97 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.916 -179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -81.1 109.36 15.59 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.854 -178.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.497 HD23 ' HA ' ' B' ' 25' ' ' LEU . 0.9 OUTLIER -119.52 146.04 45.8 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.317 0.58 . . . . 0.0 111.02 -179.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.38 137.81 52.05 Favored Pre-proline 0 C--N 1.318 -0.797 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.289 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 3.4 Cg_endo -48.24 -22.35 3.78 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 124.05 3.167 . . . . 0.0 114.419 -176.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 16.7 mtmm -73.26 -42.47 62.46 Favored 'General case' 0 C--N 1.33 -0.247 0 O-C-N 122.165 -0.334 . . . . 0.0 110.906 177.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -78.26 -32.89 49.86 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.147 0.498 . . . . 0.0 110.225 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' B' ' 27' ' ' PRO . . . -63.48 -47.89 79.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.184 -0.917 . . . . 0.0 110.268 177.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' TYR . . . . . 0.639 ' HB2' ' CH2' ' B' ' 120' ' ' TRP . 78.8 t80 -66.82 -33.39 75.5 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.713 177.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' B' ' 35' ' ' GLN . 9.0 tptp -56.92 -50.22 73.23 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.115 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.525 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -72.18 -26.3 62.01 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.727 177.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.634 HD12 ' HA ' ' B' ' 31' ' ' TYR . 18.4 mt -63.45 -51.04 67.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.858 0.361 . . . . 0.0 111.183 178.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -71.22 -31.25 67.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.395 -177.304 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -82.06 -38.29 25.15 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.822 0.344 . . . . 0.0 111.765 -177.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -110.04 108.54 59.06 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.909 -177.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -72.33 0.1 7.89 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 122.671 2.248 . . . . 0.0 111.759 176.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.22 -29.65 14.4 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.071 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.568 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 61.2 mt -82.63 109.43 16.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.948 177.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -102.23 143.57 31.85 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.798 -177.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.931 HD11 ' HB2' ' B' ' 88' ' ' PHE . 5.8 tp -100.19 127.9 46.37 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 174.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.416 HG12 ' CE ' ' B' ' 65' ' ' MET . 2.0 mt -109.13 118.3 56.3 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-O 121.235 0.54 . . . . 0.0 109.669 177.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.768 ' HB3' ' CE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -104.64 133.32 49.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.528 -0.76 . . . . 0.0 108.951 178.378 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.866 HG11 HD22 ' B' ' 70' ' ' LEU . 27.6 m -131.61 99.52 3.88 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.019 0 CA-C-N 115.034 -0.985 . . . . 0.0 109.974 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . 1.362 HH11 ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -153.93 165.27 36.64 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.614 -1.175 . . . . 0.0 109.36 -176.668 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 1.203 ' HB3' ' CG ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -66.51 129.86 94.13 Favored Pre-proline 0 C--N 1.316 -0.885 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.102 -178.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . 0.492 ' O ' ' HB2' ' B' ' 52' ' ' LYS . 26.3 Cg_endo -68.72 -16.7 42.24 Favored 'Trans proline' 0 N--CA 1.474 0.349 0 C-N-CA 123.689 2.926 . . . . 0.0 114.843 -168.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.467 ' HB2' ' HG3' ' A' ' 50' ' ' GLU . 0.4 OUTLIER -78.12 -46.62 20.19 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.101 -0.64 . . . . 0.0 112.443 -173.531 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -71.2 -33.53 70.01 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.82 0.343 . . . . 0.0 110.365 177.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.53 -44.39 97.14 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.338 175.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' B' ' 48' ' ' PRO . 1.7 ttpt -63.69 -37.08 86.0 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.991 -1.004 . . . . 0.0 111.747 -178.011 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -97.46 -44.85 6.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -171.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 1.9 mmm -90.28 -34.8 15.61 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.405 -0.518 . . . . 0.0 112.33 -171.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' GLY . . . . . 0.491 ' HA2' ' O ' ' B' ' 128' ' ' LEU . . . 149.72 145.05 4.05 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.077 -1.059 . . . . 0.0 113.764 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' LYS . . . . . 0.439 ' HG3' ' HB2' ' B' ' 128' ' ' LEU . 0.0 OUTLIER -133.9 165.07 39.48 Favored Pre-proline 0 C--N 1.324 -0.507 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 174.67 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -70.11 129.37 17.11 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 121.576 1.518 . . . . 0.0 112.559 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . 0.605 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 13.4 t70 -90.37 95.33 10.13 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 174.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.604 HG23 ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -138.27 153.14 26.26 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.598 -174.191 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -34.24 70.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.312 -176.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -132.53 79.39 1.85 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.31 0.576 . . . . 0.0 111.867 -172.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.768 ' CE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -139.08 137.62 36.37 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.482 176.287 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -120.7 129.09 53.52 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.944 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -90.29 111.74 23.04 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 173.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' MET . . . . . 0.553 ' HG2' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER -98.84 91.83 5.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.541 0.21 . . . . 0.0 110.516 -176.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.77 120.57 38.39 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 120.992 0.425 . . . . 0.0 111.543 -175.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' ARG . . . . . 0.502 ' HG2' ' CG ' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -155.55 -141.62 0.1 Allowed 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 173.376 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . 0.639 ' HA2' ' HA ' ' A' ' 91' ' ' THR . . . -80.98 -42.26 9.75 Favored Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 119.322 -1.418 . . . . 0.0 109.641 169.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' LYS . . . . . 0.587 ' HE3' ' HB2' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -152.32 43.17 0.68 Allowed 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.336 -0.932 . . . . 0.0 108.694 171.773 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.866 HD22 HG11 ' B' ' 45' ' ' VAL . 0.4 OUTLIER 55.76 2.95 0.08 Allowed 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.165 1.386 . . . . 0.0 114.523 178.456 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.817 ' HG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -45.41 -63.97 1.05 Allowed Pre-proline 0 CA--C 1.547 0.837 0 N-CA-C 113.274 0.842 . . . . 0.0 113.274 -174.417 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.573 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 61.8 Cg_endo -75.24 -12.78 21.05 Favored 'Trans proline' 0 C--N 1.355 0.899 0 C-N-CA 122.349 2.033 . . . . 0.0 113.561 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.553 ' HB3' ' HG2' ' B' ' 65' ' ' MET . 0.1 OUTLIER -89.5 2.73 54.18 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 122.318 -0.239 . . . . 0.0 111.169 -174.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.95 HD21 HD21 ' B' ' 102' ' ' LEU . 8.7 tp -72.74 -52.86 13.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.344 -177.352 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -72.13 -19.68 61.74 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.733 0.302 . . . . 0.0 111.498 -177.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -82.65 -27.57 31.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.026 -0.533 . . . . 0.0 111.648 -175.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -77.95 -27.12 49.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.772 0.32 . . . . 0.0 111.042 -177.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.24 75.38 1.3 Allowed Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.511 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 9.5 mt -129.59 145.23 51.5 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -128.03 138.47 33.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 177.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.918 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 35.6 Cg_endo -69.21 12.48 0.28 Allowed 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 123.209 2.606 . . . . 0.0 114.245 -174.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -102.77 -12.11 17.85 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 176.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.402 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -95.5 133.91 25.09 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.279 -177.274 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.568 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 2.7 Cg_exo -71.65 126.8 12.42 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 C-N-CA 122.429 2.086 . . . . 0.0 110.839 175.241 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 6.3 m -132.11 151.88 35.75 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.534 -176.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 1.6 p -125.62 141.78 44.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 178.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.825 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 16.6 m -107.73 141.03 23.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 -179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.931 ' HB2' HD11 ' B' ' 42' ' ' LEU . 8.9 t80 -119.12 141.48 48.76 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.034 -173.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . 0.589 ' HB2' ' O ' ' B' ' 88' ' ' PHE . 1.4 m 81.36 75.98 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.618 0.767 . . . . 0.0 111.754 -179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.574 ' HE3' ' HA ' ' B' ' 114' ' ' GLU . 0.0 OUTLIER -95.19 -23.66 17.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.191 -177.944 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -100.87 35.93 2.07 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -175.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -146.23 -88.67 0.1 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.318 176.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' B' ' 94' ' ' ARG . . . -74.64 -24.52 58.84 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 116.196 -0.456 . . . . 0.0 109.844 174.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' B' ' 93' ' ' ALA . 12.1 mmt180 80.72 83.8 0.04 OUTLIER 'General case' 0 C--O 1.234 0.266 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.802 178.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.825 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -66.89 -10.57 50.03 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.151 -0.932 . . . . 0.0 110.625 175.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.52 -33.58 71.55 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.69 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -66.07 -29.75 70.14 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.602 178.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' ALA . . . . . 0.425 ' HB2' HD21 ' B' ' 70' ' ' LEU . . . -75.88 -56.04 5.05 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.293 0.568 . . . . 0.0 110.685 176.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 99' ' ' GLY . . . . . 0.42 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -71.74 -48.63 27.32 Favored Glycine 0 N--CA 1.446 -0.648 0 CA-C-N 115.023 -0.99 . . . . 0.0 114.464 -171.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 100' ' ' LYS . . . . . 0.585 ' HB2' ' HB3' ' B' ' 21' ' ' ASP . 0.0 OUTLIER -68.41 -33.71 74.72 Favored 'General case' 0 C--N 1.326 -0.432 0 O-C-N 122.497 -0.413 . . . . 0.0 111.107 -174.154 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . 0.409 HG22 ' CE2' ' B' ' 105' ' ' TYR . 6.2 m -72.07 -36.01 69.44 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.656 0.265 . . . . 0.0 110.889 176.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.95 HD21 HD21 ' B' ' 74' ' ' LEU . 8.9 mt -64.18 -47.75 78.59 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.446 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.486 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.6 OUTLIER -65.1 -26.99 68.45 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.791 0.329 . . . . 0.0 110.597 179.048 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 2.9 mt-10 -73.11 -6.79 48.02 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.33 176.457 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . 0.409 ' CE2' HG22 ' B' ' 101' ' ' THR . 22.0 m-30 -106.07 -8.37 17.53 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.961 0.41 . . . . 0.0 110.284 175.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 109.28 60.92 0.52 Allowed Glycine 0 N--CA 1.447 -0.621 0 C-N-CA 120.418 -0.896 . . . . 0.0 112.49 175.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' PHE . . . . . 0.66 ' CE1' HD22 ' B' ' 102' ' ' LEU . 1.3 m-85 -104.48 139.61 39.15 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 176.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 -77.25 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.498 0.499 . . . . 0.0 111.522 -175.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.503 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 2.7 m -129.94 109.05 10.59 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.141 0.495 . . . . 0.0 111.238 -178.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' ILE . . . . . 0.563 HG12 ' HE3' ' B' ' 22' ' ' MET . 2.3 tt -115.77 130.33 70.62 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.672 -177.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -114.6 146.85 40.32 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.45 -177.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.63 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 7.0 t-20 -111.27 138.4 47.79 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 172.098 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.508 ' CB ' ' HD1' ' B' ' 88' ' ' PHE . 65.5 m -87.83 112.64 22.68 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -174.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.574 ' HA ' ' HE3' ' B' ' 90' ' ' LYS . 5.5 tp10 -62.06 145.76 52.27 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.966 176.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.75 -110.6 3.32 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.434 -0.889 . . . . 0.0 111.624 -174.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . 0.529 ' HA3' ' S3 ' ' B' ' 139' ' ' PS5 . . . 160.37 -162.5 33.35 Favored Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 111.621 -0.592 . . . . 0.0 111.621 179.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -58.88 -36.19 74.24 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.011 0.434 . . . . 0.0 110.699 179.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.607 ' HB3' ' S5 ' ' B' ' 139' ' ' PS5 . 3.5 t70 -61.85 -35.06 77.17 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.406 177.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 119' ' ' LYS . . . . . 0.539 ' O ' ' HG2' ' B' ' 123' ' ' GLU . 0.0 OUTLIER -74.01 -33.42 63.78 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 116.623 -0.262 . . . . 0.0 110.806 177.584 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.925 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 25.9 t-105 -57.6 -52.96 63.28 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 176.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.59 -39.84 95.01 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.024 177.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -70.67 -35.15 72.7 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 112.341 0.496 . . . . 0.0 112.341 -174.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 19.1 mm-40 -74.83 -4.24 36.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.813 0.34 . . . . 0.0 110.519 -179.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.07 23.85 73.23 Favored Glycine 0 N--CA 1.446 -0.677 0 C-N-CA 120.896 -0.669 . . . . 0.0 111.705 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.49 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 72.4 mt -76.67 160.78 76.25 Favored Pre-proline 0 C--N 1.322 -0.609 0 N-CA-C 110.021 -0.362 . . . . 0.0 110.021 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.49 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 29.5 Cg_endo -61.39 108.26 0.58 Allowed 'Trans proline' 0 C--O 1.236 0.397 0 C-N-CA 122.35 2.033 . . . . 0.0 111.221 178.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -127.71 156.01 43.08 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.714 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 128' ' ' LEU . . . . . 0.605 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 8.4 mt -110.55 100.66 9.43 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 120.897 0.38 . . . . 0.0 110.398 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -102.37 143.09 32.56 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 173.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.05 92.42 7.87 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-N 118.586 0.63 . . . . 0.0 109.319 -178.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -38.47 112.4 0.23 Allowed 'General case' 0 C--N 1.33 -0.275 0 O-C-N 124.321 1.013 . . . . 0.0 112.474 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -113.62 87.71 2.67 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.14 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -98.41 -10.01 24.36 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.773 -178.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 36.5 t-80 -72.91 -32.88 65.63 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.961 0.41 . . . . 0.0 110.179 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -76.39 68.31 2.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.29 -179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -79.87 -6.05 56.66 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.397 0.618 . . . . 0.0 109.543 175.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 19.3 t-160 . . . . . 0 C--O 1.248 1.012 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 171.715 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' PS5 . . . . . 0.458 ' S4 ' ' HA3' ' A' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 139' ' ' PS5 . . . . . 0.607 ' S5 ' ' HB3' ' B' ' 118' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -96.04 166.86 11.56 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 177.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -99.5 7.5 45.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.827 0.346 . . . . 0.0 111.304 -175.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.651 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -49.98 -23.45 5.48 Favored Glycine 0 CA--C 1.522 0.493 0 CA-C-N 115.127 -0.942 . . . . 0.0 114.061 -174.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -73.78 -32.68 63.9 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 111.895 0.331 . . . . 0.0 111.895 178.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm -64.07 -47.38 80.37 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.121 0.415 . . . . 0.0 112.121 -173.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.651 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.3 p90 -91.1 -23.19 20.38 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.967 -175.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.654 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 2.9 t70 -53.59 -54.92 30.69 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.852 0.358 . . . . 0.0 110.629 -178.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.96 -42.24 89.42 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.526 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.518 ' HB ' ' CZ ' ' B' ' 105' ' ' TYR . 0.0 OUTLIER -68.91 -44.98 72.03 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.41 -178.505 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.559 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.6 OUTLIER -57.93 -47.41 82.94 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.253 0.549 . . . . 0.0 110.074 -179.377 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.517 ' HD2' ' HD2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -64.76 -26.29 68.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.107 177.127 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.13 -40.78 64.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.883 0.373 . . . . 0.0 111.392 178.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.1 mt-30 -72.36 -49.88 30.84 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.793 179.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 3.0 t -62.07 -36.47 74.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.303 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.517 ' HD2' ' HD2' ' A' ' 12' ' ' LYS . 0.1 OUTLIER -64.14 -30.05 71.14 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.566 0.222 . . . . 0.0 111.49 179.558 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.7 -27.02 68.63 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.066 0.46 . . . . 0.0 110.687 177.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.439 ' HB1' ' HB1' ' A' ' 96' ' ' ALA . . . -73.62 -30.13 62.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.397 177.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -77.02 -24.15 52.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 121.528 0.68 . . . . 0.0 110.302 172.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.15 -18.86 35.35 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.981 -1.008 . . . . 0.0 111.234 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -71.03 -24.21 62.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.787 -175.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.864 ' HE3' ' HA3' ' A' ' 99' ' ' GLY . 14.5 mtp -121.23 178.47 4.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.691 0.282 . . . . 0.0 111.158 -178.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.8 t -83.7 112.45 21.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.541 179.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -78.28 103.19 8.06 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.174 -176.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.421 ' HA ' HD23 ' A' ' 25' ' ' LEU . 3.2 mt -112.08 139.62 47.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.979 -179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.39 147.77 57.35 Favored Pre-proline 0 C--N 1.319 -0.735 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.897 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.532 ' HB3' ' CE3' ' A' ' 120' ' ' TRP . 26.9 Cg_exo -34.18 -56.42 0.43 Allowed 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 124.536 3.49 . . . . 0.0 114.394 -175.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.601 ' HG3' ' OE1' ' A' ' 123' ' ' GLU . 4.4 mttp -63.37 -37.82 88.76 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.51 -34.91 76.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.205 0.526 . . . . 0.0 110.343 179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.621 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -71.79 -47.37 53.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.518 176.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.597 ' HA ' HD12 ' A' ' 34' ' ' LEU . 82.6 t80 -60.02 -32.25 70.71 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.351 179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -58.73 -51.87 68.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.899 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.438 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -74.31 -27.16 60.58 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.897 -0.321 . . . . 0.0 111.033 179.271 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.621 ' HG ' ' O ' ' A' ' 30' ' ' ALA . 81.6 mt -62.98 -55.35 26.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.989 0.423 . . . . 0.0 111.263 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.684 ' HA ' ' HD2' ' A' ' 60' ' ' LYS . 0.1 OUTLIER -75.85 -22.27 56.39 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.071 -173.601 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -93.72 -24.29 17.89 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.883 0.373 . . . . 0.0 110.791 -177.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -129.49 94.11 33.54 Favored Pre-proline 0 C--N 1.327 -0.375 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 175.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HA ' ' ND2' ' A' ' 61' ' ' ASN . 40.8 Cg_endo -68.81 9.58 0.44 Allowed 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 122.73 2.287 . . . . 0.0 113.103 -179.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -91.12 -29.17 17.44 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 170.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.614 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 26.2 mt -83.16 100.91 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.458 173.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.66 HG21 ' HE2' ' A' ' 63' ' ' LYS . 9.9 m -92.61 146.8 23.39 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.401 -175.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.966 HD11 ' HB2' ' A' ' 88' ' ' PHE . 8.3 tp -100.74 128.3 46.84 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 173.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.418 HG23 ' SD ' ' A' ' 65' ' ' MET . 13.1 mt -109.59 118.15 56.13 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.442 177.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.852 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -102.39 124.02 47.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.225 0.536 . . . . 0.0 109.869 -178.786 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -109.26 96.68 4.87 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.429 176.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.7 ' NE ' ' HA ' ' A' ' 46' ' ' ARG . 0.4 OUTLIER -150.06 163.33 38.45 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.294 -176.32 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.58 ' HB3' ' HB2' ' A' ' 50' ' ' GLU . 6.0 t70 -75.91 137.28 69.6 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.786 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -59.6 -29.95 91.13 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.677 2.251 . . . . 0.0 112.367 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.23 -36.23 47.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.809 178.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.58 ' HB2' ' HB3' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -65.88 -35.79 81.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.402 0.62 . . . . 0.0 109.559 173.251 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.865 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.0 OUTLIER -65.51 -33.67 76.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.734 177.232 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.67 -42.08 61.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.648 179.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.06 -45.55 23.27 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -175.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.1 mtp -101.41 -34.7 9.48 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -172.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 116.41 179.14 18.05 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.56 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.865 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -148.23 155.7 43.09 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -179.108 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.475 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 23.4 Cg_endo -65.52 137.51 50.91 Favored 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.413 2.076 . . . . 0.0 112.598 -179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.69 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 25.8 t0 -111.95 84.72 2.01 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.229 0.537 . . . . 0.0 110.595 178.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.776 HG22 ' HB2' ' A' ' 62' ' ' TYR . 13.0 m -112.02 163.98 8.41 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.005 176.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.684 ' HD2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -54.83 -42.94 72.53 Favored 'General case' 0 C--N 1.326 -0.42 0 O-C-N 123.634 0.584 . . . . 0.0 111.59 -177.546 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.409 ' ND2' ' HA ' ' A' ' 38' ' ' PRO . 27.6 p-10 -120.47 76.76 1.21 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.724 0.773 . . . . 0.0 111.206 -178.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.852 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 2.4 t80 -116.99 125.97 52.2 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.431 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.66 ' HE2' HG21 ' A' ' 41' ' ' THR . 6.3 mttm -122.02 123.53 41.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.124 176.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.428 ' HB2' ' OH ' ' A' ' 62' ' ' TYR . 11.4 t-160 -94.64 132.93 38.85 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 -179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.628 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -107.42 150.84 26.3 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.66 178.174 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.451 ' HB2' ' HB3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -80.65 50.46 1.33 Allowed 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -173.147 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.551 ' HD3' ' HA ' ' A' ' 47' ' ' ASP . 11.6 mtm180 61.2 -79.44 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 171.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -100.72 -3.44 55.05 Favored Glycine 0 CA--C 1.501 -0.842 0 N-CA-C 110.595 -1.002 . . . . 0.0 110.595 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.496 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.3 OUTLIER -116.12 29.34 8.03 Favored 'General case' 0 N--CA 1.436 -1.125 0 CA-C-N 114.22 -0.99 . . . . 0.0 108.944 177.586 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.628 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER -66.51 -43.57 84.9 Favored 'General case' 0 CA--C 1.512 -0.489 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 174.384 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.833 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.8 mp0 -49.05 -60.1 5.28 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.708 -177.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.833 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 13.8 Cg_exo -71.26 -18.09 30.54 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 122.248 1.966 . . . . 0.0 113.124 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.482 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -88.69 -15.45 34.82 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.616 0.246 . . . . 0.0 111.414 -178.434 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.872 HD21 HD21 ' A' ' 102' ' ' LEU . 3.3 tp -57.88 -52.8 63.99 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.239 0.543 . . . . 0.0 110.507 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.572 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -68.14 -29.4 68.29 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.356 -0.838 . . . . 0.0 111.651 -179.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.53 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 1.6 mtpt -75.69 -30.39 59.33 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.072 -176.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 18.9 m -78.85 -38.01 38.98 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.414 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 107.92 90.5 2.13 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.537 -0.84 . . . . 0.0 112.389 177.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.3 mt -134.23 148.54 50.87 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.848 0.356 . . . . 0.0 111.084 -179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.47 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -134.45 138.25 29.67 Favored Pre-proline 0 C--N 1.328 -0.331 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 -179.358 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.561 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 44.4 Cg_exo -63.88 -1.06 3.07 Favored 'Trans proline' 0 N--CA 1.478 0.587 0 C-N-CA 123.368 2.712 . . . . 0.0 114.608 -172.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.414 ' O ' ' HD2' ' A' ' 108' ' ' LYS . 12.7 mm-40 -97.1 -5.88 36.34 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.039 0.447 . . . . 0.0 110.15 175.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 2.1 mttm -92.82 116.0 65.8 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.295 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.614 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 17.1 Cg_exo -63.27 141.44 82.1 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.436 2.09 . . . . 0.0 110.411 174.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.482 HG23 HD12 ' A' ' 110' ' ' ILE . 0.5 OUTLIER -138.58 146.28 26.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 CA-C-O 121.091 0.472 . . . . 0.0 111.384 -175.246 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.512 HG13 HD12 ' A' ' 42' ' ' LEU . 1.5 p -119.91 142.9 33.33 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 172.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 5.3 m -102.85 127.43 56.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.038 0.447 . . . . 0.0 110.732 -177.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.966 ' HB2' HD11 ' A' ' 42' ' ' LEU . 3.7 t80 -113.47 151.95 30.78 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.5 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' CYS . . . . . 0.436 ' HB3' ' O ' ' A' ' 88' ' ' PHE . 5.4 p 179.36 -169.68 0.11 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.526 -176.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.447 ' HD2' ' HB3' ' A' ' 118' ' ' ASP . 0.3 OUTLIER -141.71 56.2 1.5 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 177.528 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.458 HG23 ' HA3' ' B' ' 68' ' ' GLY . 0.7 OUTLIER -175.87 -21.0 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.707 -174.35 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.576 ' HA ' ' S2 ' ' A' ' 138' ' ' PS5 . . . 74.53 -43.88 0.54 Allowed 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.862 0.865 . . . . 0.0 112.618 177.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -55.07 -54.3 44.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.086 0.772 . . . . 0.0 113.086 -173.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -75.47 -22.9 56.89 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.93 -176.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.24 -53.72 27.54 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 174.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.439 ' HB1' ' HB1' ' A' ' 18' ' ' ALA . . . -59.28 -36.75 76.13 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.132 176.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -67.17 -36.8 82.56 Favored 'General case' 0 C--O 1.223 -0.337 0 C-N-CA 121.087 -0.245 . . . . 0.0 110.824 178.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . 0.64 ' HA ' ' HZ ' ' B' ' 11' ' ' PHE . . . -74.47 -47.96 30.27 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.067 0.46 . . . . 0.0 110.644 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.864 ' HA3' ' HE3' ' A' ' 22' ' ' MET . . . -69.77 -52.99 17.38 Favored Glycine 0 N--CA 1.447 -0.591 0 CA-C-N 115.666 -0.697 . . . . 0.0 113.626 -176.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.582 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -63.39 -30.7 71.79 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 122.66 -0.318 . . . . 0.0 111.372 -175.21 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.449 HG22 ' CE2' ' A' ' 105' ' ' TYR . 47.3 m -73.05 -37.95 66.67 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.859 0.362 . . . . 0.0 110.846 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.872 HD21 HD21 ' A' ' 74' ' ' LEU . 12.8 mt -64.2 -46.11 85.37 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.153 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.37 -26.49 68.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.139 0.495 . . . . 0.0 110.349 177.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -72.98 -9.21 58.48 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.491 178.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.449 ' CE2' HG22 ' A' ' 101' ' ' THR . 20.9 m-85 -106.03 -18.46 14.02 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.867 0.365 . . . . 0.0 110.6 177.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 117.04 54.95 0.31 Allowed Glycine 0 N--CA 1.449 -0.461 0 C-N-CA 120.628 -0.796 . . . . 0.0 112.875 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.522 ' CE1' HD22 ' A' ' 102' ' ' LEU . 1.1 m-85 -94.47 167.92 11.2 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.711 -0.287 . . . . 0.0 110.261 176.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.456 ' HB3' ' H ' ' A' ' 109' ' ' THR . 2.4 tttt -77.17 -98.37 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.83 0.348 . . . . 0.0 111.303 -176.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.456 ' H ' ' HB3' ' A' ' 108' ' ' LYS . 0.2 OUTLIER -107.04 121.71 45.01 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.524 -179.225 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.482 HD12 HG23 ' A' ' 85' ' ' VAL . 1.0 OUTLIER -121.91 126.77 74.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.49 0.662 . . . . 0.0 111.477 -174.775 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -119.47 147.53 44.31 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.254 -176.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 -117.71 144.78 44.94 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 176.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -79.5 131.3 36.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.473 0.654 . . . . 0.0 111.348 -172.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.409 ' HA ' ' OE1' ' A' ' 114' ' ' GLU . 3.8 tp10 -98.2 3.8 48.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.511 176.354 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.82 -92.9 2.28 Favored Glycine 0 N--CA 1.443 -0.84 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.203 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.419 ' HA2' ' O ' ' A' ' 89' ' ' CYS . . . 141.32 161.44 8.71 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.337 -0.705 . . . . 0.0 111.337 -177.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' MET . . . . . 0.547 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -56.97 -41.38 78.25 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 117.115 0.457 . . . . 0.0 110.954 -176.97 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.447 ' HB3' ' HD2' ' A' ' 90' ' ' LYS . 9.5 p-10 -69.37 -27.61 65.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.424 177.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.457 ' O ' ' HG3' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -72.65 -32.49 65.9 Favored 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.761 176.629 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.574 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 41.5 t-105 -56.99 -47.28 81.18 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 176.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.4 mt -66.44 -38.22 86.9 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.753 175.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.452 ' HB2' ' HA ' ' A' ' 119' ' ' LYS . 64.6 mt-10 -65.67 -37.3 86.12 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.558 -177.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.601 ' OE1' ' HG3' ' A' ' 28' ' ' LYS . 15.5 mt-10 -83.58 4.08 29.81 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.946 0.403 . . . . 0.0 110.925 -179.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 70.48 28.8 70.61 Favored Glycine 0 C--N 1.33 0.226 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.344 174.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.482 HD21 ' HG2' ' A' ' 28' ' ' LYS . 71.7 mt -85.83 158.88 55.84 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-O 120.516 0.198 . . . . 0.0 110.513 -178.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -57.25 119.06 6.06 Favored 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 123.415 2.743 . . . . 0.0 112.564 -177.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 3.4 m -133.19 158.31 43.16 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.032 0.444 . . . . 0.0 111.459 -178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.69 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 1.1 mt -113.97 111.31 21.45 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.295 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -142.47 150.76 40.96 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -86.64 70.59 10.42 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 120.99 0.424 . . . . 0.0 110.69 -177.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -67.06 -25.77 66.41 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.572 177.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -109.77 112.36 24.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.557 177.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -92.84 68.11 4.5 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.891 178.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 18.8 t-80 -77.18 113.18 14.66 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.495 -175.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -156.8 116.98 3.56 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.941 -0.572 . . . . 0.0 109.955 176.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -113.06 158.33 20.47 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.491 -175.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 1.4 t60 . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.421 177.984 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -112.11 148.24 34.38 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' MET . . . . . 0.561 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mmm -90.03 3.65 52.6 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.469 -173.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.698 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.45 -36.26 76.22 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.474 -179.004 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.67 -32.29 73.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.857 0.361 . . . . 0.0 111.027 176.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -63.51 -48.12 78.87 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.994 -176.018 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.698 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.7 p90 -90.62 -22.46 21.2 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 120.338 -0.545 . . . . 0.0 112.192 -177.296 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . 0.572 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -53.67 -47.43 70.41 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.986 0.422 . . . . 0.0 110.756 -177.153 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.9 -43.6 98.36 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.107 178.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.45 -42.57 92.2 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.522 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' PHE . . . . . 0.64 ' HZ ' ' HA ' ' A' ' 98' ' ' ALA . 0.2 OUTLIER -55.59 -50.41 70.16 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.006 0.431 . . . . 0.0 111.107 -176.797 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' LYS . . . . . 0.469 ' HD2' ' HA ' ' B' ' 12' ' ' LYS . 20.9 tptt -69.68 -23.66 63.48 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.191 177.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.71 75.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.861 176.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -71.43 -50.14 34.78 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.229 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -56.73 -34.59 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.242 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.429 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -63.07 -31.97 73.23 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.529 178.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.32 -26.21 64.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.861 0.362 . . . . 0.0 111.193 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.27 -45.6 83.82 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.702 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.408 ' HG3' ' O ' ' B' ' 16' ' ' LYS . 1.1 ptmt -75.3 -21.01 58.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.099 0.476 . . . . 0.0 111.067 176.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.22 -17.14 60.93 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.543 -178.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.4 -19.73 60.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.92 0.391 . . . . 0.0 111.554 -177.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.729 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 2.6 ptm -120.86 -179.54 4.04 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.758 0.313 . . . . 0.0 110.916 -179.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 t -78.34 106.71 9.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.109 -179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -74.41 103.56 4.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.186 0.517 . . . . 0.0 110.267 178.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' B' ' 25' ' ' LEU . 1.5 mt -116.0 141.35 48.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.885 -178.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -84.45 144.37 43.09 Favored Pre-proline 0 C--N 1.318 -0.764 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.374 179.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.473 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 3.9 Cg_exo -40.68 -34.13 1.19 Allowed 'Trans proline' 0 CA--C 1.537 0.67 0 C-N-CA 124.814 3.676 . . . . 0.0 115.402 -174.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.524 ' HE3' ' HB3' ' B' ' 123' ' ' GLU . 1.5 mttt -74.47 -44.04 53.38 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 118.672 0.669 . . . . 0.0 111.266 179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.24 -33.38 75.22 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.247 0.546 . . . . 0.0 110.15 179.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.66 -46.79 52.15 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.821 177.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' TYR . . . . . 0.557 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.6 t80 -63.96 -32.9 74.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.522 0.201 . . . . 0.0 111.037 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' B' ' 36' ' ' GLU . 0.3 OUTLIER -54.59 -53.73 50.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.898 -179.741 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.461 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -74.78 -27.69 60.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.156 179.086 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.557 ' HB2' ' HA ' ' B' ' 31' ' ' TYR . 6.2 mt -62.45 -56.59 16.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.002 0.429 . . . . 0.0 111.418 -178.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -77.36 -21.71 52.89 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.739 -0.664 . . . . 0.0 112.222 -174.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' B' ' 32' ' ' LYS . 0.0 OUTLIER -91.05 -27.94 18.28 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.578 -177.447 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 17.7 m-80 -120.42 93.31 48.21 Favored Pre-proline 0 C--N 1.325 -0.459 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . 0.511 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 31.5 Cg_exo -64.68 3.64 0.84 Allowed 'Trans proline' 0 CA--C 1.533 0.449 0 C-N-CA 123.229 2.619 . . . . 0.0 114.067 -174.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' B' ' 83' ' ' LYS . 20.4 t70 -92.18 -22.45 19.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 174.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.555 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 53.5 mt -78.31 107.66 10.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.751 174.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.534 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.6 OUTLIER -97.28 145.05 26.47 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.36 -175.95 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.886 HD11 ' HB2' ' B' ' 88' ' ' PHE . 11.1 tp -104.76 125.49 50.89 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.631 -0.507 . . . . 0.0 109.631 175.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.423 HD11 HD11 ' B' ' 79' ' ' LEU . 1.1 mp -102.33 116.61 46.31 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 175.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.754 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.72 121.5 41.76 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -176.445 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.738 HG12 ' HA ' ' B' ' 67' ' ' ARG . 0.0 OUTLIER -110.39 96.48 4.72 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.826 -0.805 . . . . 0.0 108.826 178.843 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . 0.628 ' NE ' ' HA ' ' B' ' 46' ' ' ARG . 1.7 tpm_? -150.59 155.91 40.34 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.376 -175.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.434 ' HA ' ' HD3' ' B' ' 67' ' ' ARG . 1.0 OUTLIER -73.1 136.55 79.29 Favored Pre-proline 0 C--N 1.318 -0.766 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.72 -177.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -60.45 -30.57 91.09 Favored 'Trans proline' 0 N--CA 1.466 -0.126 0 C-N-CA 122.742 2.294 . . . . 0.0 112.513 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -73.24 -42.88 62.07 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.949 -179.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -33.2 75.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.181 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.737 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 tp -62.11 -33.87 75.27 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.629 176.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -70.2 -40.28 74.68 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.77 178.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.67 -41.49 13.34 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.715 0.635 . . . . 0.0 112.715 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 3.1 mtp -97.65 -34.14 11.05 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.655 -174.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 113.07 177.95 19.55 Favored Glycine 0 N--CA 1.443 -0.894 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.205 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' LYS . . . . . 0.737 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -147.24 160.72 38.81 Favored Pre-proline 0 C--N 1.323 -0.562 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.408 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.468 ' HD2' ' HB2' ' B' ' 56' ' ' LYS . 11.9 Cg_endo -60.53 130.52 33.93 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.019 1.813 . . . . 0.0 112.887 -178.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . 0.419 ' HB2' ' C ' ' B' ' 127' ' ' SER . 48.0 t0 -92.34 97.69 11.03 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 173.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.647 HG23 ' HB3' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -139.83 159.41 27.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.29 -175.879 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.63 -28.29 36.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.255 -176.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.511 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 13.4 p-10 -130.02 69.98 1.44 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.342 0.591 . . . . 0.0 111.633 -174.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.754 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.0 OUTLIER -136.45 142.53 43.61 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.274 176.696 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.722 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 34.2 mttm -127.69 121.9 31.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.555 -177.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -76.93 129.23 35.88 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.529 -178.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' MET . . . . . 0.871 ' HB3' ' HB2' ' B' ' 70' ' ' LEU . 14.6 mmt -100.14 142.1 32.07 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.721 174.341 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -78.9 43.58 0.51 Allowed 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -174.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' ARG . . . . . 0.738 ' HA ' HG12 ' B' ' 45' ' ' VAL . 26.6 mtm180 63.43 -77.44 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.636 0.775 . . . . 0.0 112.465 174.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . 0.458 ' HA3' HG23 ' A' ' 91' ' ' THR . . . -99.14 -45.05 2.27 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 111.425 -0.67 . . . . 0.0 111.425 -179.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' LYS . . . . . 0.454 ' O ' ' HD2' ' B' ' 72' ' ' PRO . 2.9 mttt -83.34 39.32 0.65 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.051 0.453 . . . . 0.0 110.33 174.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.871 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -71.87 -37.66 70.16 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 174.645 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.606 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.89 -57.08 11.03 Favored Pre-proline 0 CA--C 1.539 0.544 0 CA-C-N 114.542 -1.208 . . . . 0.0 112.09 -175.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.486 ' O ' ' HG3' ' B' ' 76' ' ' LYS . 9.6 Cg_exo -71.63 -17.67 29.57 Favored 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.21 1.94 . . . . 0.0 112.35 179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.527 HD22 ' HA ' ' B' ' 73' ' ' LEU . 0.2 OUTLIER -80.51 -22.81 40.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.878 0.37 . . . . 0.0 110.131 177.348 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.916 HD21 HD21 ' B' ' 102' ' ' LEU . 4.6 tp -57.19 -52.02 66.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.31 177.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.654 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -65.73 -34.27 77.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.441 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . 0.486 ' HG3' ' O ' ' B' ' 72' ' ' PRO . 0.2 OUTLIER -71.46 -25.75 62.43 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.904 0.383 . . . . 0.0 111.019 -178.191 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' SER . . . . . 0.722 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 47.7 m -78.19 -41.6 34.1 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.224 179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.16 60.26 1.33 Allowed Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.632 -0.794 . . . . 0.0 111.65 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.423 HD11 HD11 ' B' ' 43' ' ' ILE . 7.6 mt -94.72 151.15 19.51 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 110.161 -0.311 . . . . 0.0 110.161 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.0 OUTLIER -122.26 130.52 24.66 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 -179.914 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.437 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 59.5 Cg_exo -60.63 -6.95 6.39 Favored 'Trans proline' 0 CA--C 1.535 0.568 0 C-N-CA 123.697 2.931 . . . . 0.0 114.935 -171.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -90.6 -7.51 52.57 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 121.827 -0.545 . . . . 0.0 110.389 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' B' ' 39' ' ' ASP . 4.3 mttp -82.02 126.09 75.75 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.607 -178.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.555 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 5.9 Cg_exo -72.24 122.16 8.13 Favored 'Trans proline' 0 N--CA 1.454 -0.826 0 C-N-CA 122.192 1.928 . . . . 0.0 109.969 171.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 13.0 m -127.62 153.21 36.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 CA-C-O 121.101 0.477 . . . . 0.0 111.565 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.406 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 1.4 p -124.28 143.05 39.0 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 109.095 -0.705 . . . . 0.0 109.095 176.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 m -106.43 122.94 60.9 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-O 120.8 0.333 . . . . 0.0 110.513 -179.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.886 ' HB2' HD11 ' B' ' 42' ' ' LEU . 0.3 OUTLIER -91.69 123.58 35.19 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.852 -178.845 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . 0.562 ' O ' ' HB2' ' B' ' 90' ' ' LYS . 10.9 p -106.22 -165.26 1.08 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 -168.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.562 ' HB2' ' O ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER 153.19 -22.72 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.854 1.662 . . . . 0.0 107.189 179.387 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' THR . . . . . 0.474 HG23 ' HB3' ' A' ' 67' ' ' ARG . 0.2 OUTLIER -105.17 25.95 9.95 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 114.375 -1.284 . . . . 0.0 109.79 174.462 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . 50.04 -103.57 0.13 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-N 114.658 -1.155 . . . . 0.0 113.327 176.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -54.74 -28.24 46.89 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.91 1.078 . . . . 0.0 113.91 -170.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' ARG . . . . . 0.428 ' O ' ' HD2' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -69.72 -31.37 69.32 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 119.939 -0.705 . . . . 0.0 112.383 -174.343 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -68.28 -47.86 66.56 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 174.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' B' ' 100' ' ' LYS . . . -59.57 -34.29 72.51 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.172 177.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -72.94 -35.23 66.94 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.596 -0.274 . . . . 0.0 110.811 178.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' ALA . . . . . 0.559 ' HA ' ' HZ ' ' A' ' 11' ' ' PHE . . . -71.4 -44.18 65.42 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.034 0.445 . . . . 0.0 110.561 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 99' ' ' GLY . . . . . 0.428 ' HA3' ' HE1' ' B' ' 22' ' ' MET . . . -76.02 -51.47 6.91 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-N 115.736 -0.665 . . . . 0.0 113.424 -177.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 100' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' B' ' 104' ' ' GLU . 0.0 OUTLIER -62.8 -31.77 72.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.907 0.353 . . . . 0.0 111.268 -174.791 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . 0.5 HG22 ' CE2' ' B' ' 105' ' ' TYR . 10.8 m -73.03 -35.78 66.82 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.735 0.302 . . . . 0.0 110.98 175.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.916 HD21 HD21 ' B' ' 74' ' ' LEU . 6.8 mt -62.65 -49.98 73.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.144 178.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -64.44 -27.01 68.7 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.874 0.368 . . . . 0.0 110.409 178.208 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.463 ' HB2' ' O ' ' B' ' 100' ' ' LYS . 4.7 tt0 -71.14 -8.42 53.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.029 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . 0.518 ' CZ ' ' HB ' ' A' ' 10' ' ' THR . 21.4 m-30 -112.01 -8.09 14.08 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.778 0.323 . . . . 0.0 111.117 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.66 49.7 0.34 Allowed Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.127 -1.035 . . . . 0.0 112.98 174.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' PHE . . . . . 0.572 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.0 m-85 -99.43 149.26 23.38 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 176.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . 0.447 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -63.01 -91.34 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.42 -175.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.447 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.9 OUTLIER -116.36 122.25 44.31 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.34 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' ILE . . . . . 0.567 HG12 ' HE3' ' B' ' 22' ' ' MET . 1.2 tt -120.22 129.13 75.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.275 0.559 . . . . 0.0 111.285 -175.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' TYR . . . . . 0.406 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 1.2 m-85 -116.59 148.68 40.68 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.067 -177.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.729 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 10.3 t-20 -115.52 143.09 45.83 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 175.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.445 ' HB3' ' HA ' ' B' ' 88' ' ' PHE . 13.7 p -80.97 133.97 35.61 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.425 0.631 . . . . 0.0 111.511 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -86.18 123.34 31.35 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.507 176.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . 0.726 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 97.2 -79.29 0.67 Allowed Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.673 179.462 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . 0.423 ' O ' ' HB2' ' B' ' 119' ' ' LYS . . . 150.27 -175.89 29.13 Favored Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 120.321 -0.942 . . . . 0.0 112.915 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 117' ' ' MET . . . . . 0.733 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -61.87 -27.47 68.81 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 122.933 0.493 . . . . 0.0 111.697 -176.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.425 ' O ' ' HG3' ' B' ' 122' ' ' GLU . 7.5 p-10 -67.85 -24.29 65.25 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.693 178.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 119' ' ' LYS . . . . . 0.726 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -72.18 -32.86 67.2 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 116.543 -0.298 . . . . 0.0 110.783 178.273 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.773 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 23.7 t-105 -55.57 -48.77 74.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.956 0.407 . . . . 0.0 109.973 176.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.484 ' HA ' HD23 ' B' ' 121' ' ' LEU . 0.8 OUTLIER -65.52 -37.76 87.68 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.756 176.297 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.445 ' HB2' ' HA ' ' B' ' 119' ' ' LYS . 21.0 mt-10 -67.9 -41.26 82.98 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.157 0.429 . . . . 0.0 112.157 -176.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . 0.68 ' HG2' ' O ' ' B' ' 119' ' ' LYS . 3.9 mm-40 -74.02 -7.84 53.92 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.819 0.342 . . . . 0.0 110.992 -178.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 79.28 25.95 58.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.107 -0.568 . . . . 0.0 112.29 178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.572 ' HG ' ' HB2' ' B' ' 123' ' ' GLU . 58.9 mt -80.44 159.97 68.57 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.56 0.219 . . . . 0.0 110.516 -178.112 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.525 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 18.5 Cg_endo -56.81 116.89 3.52 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 123.057 2.505 . . . . 0.0 112.121 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . 0.419 ' C ' ' HB2' ' B' ' 58' ' ' ASP . 0.0 OUTLIER -126.86 149.18 49.87 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.461 -177.872 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.78 100.1 12.88 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 173.51 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.82 134.56 39.01 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.081 -173.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 9.5 ttm-85 -128.15 71.35 1.38 Allowed 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.163 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -21.18 64.97 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.458 -174.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -89.32 109.9 20.74 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.824 0.345 . . . . 0.0 110.312 177.246 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -75.73 99.06 4.27 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.687 -178.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 -67.58 103.96 1.48 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.221 178.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -171.57 111.68 0.32 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.562 178.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -139.38 170.21 16.35 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.633 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.556 -179.341 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' PS5 . . . . . 0.576 ' S2 ' ' HA ' ' A' ' 92' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 139' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.983 0 N-CA-C 110.315 -0.254 . . . . 0.0 110.315 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -113.71 159.79 19.34 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.367 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.0 12.8 18.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.325 -178.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.763 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -55.7 -29.9 55.3 Favored Glycine 0 C--N 1.33 0.227 0 CA-C-N 115.653 -0.703 . . . . 0.0 112.95 -177.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -68.88 -39.81 79.58 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.799 0.333 . . . . 0.0 110.665 177.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -66.98 -58.45 4.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.562 -174.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.763 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 3.4 p90 -68.09 -25.32 65.27 Favored 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 120.021 -0.671 . . . . 0.0 110.975 -175.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.25 -50.78 64.11 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.47 -45.34 94.09 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.787 179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.84 -47.53 77.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.796 0.331 . . . . 0.0 110.993 -179.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.47 ' CD1' ' HB3' ' B' ' 71' ' ' GLU . 0.7 OUTLIER -57.12 -42.86 81.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.282 0.563 . . . . 0.0 109.787 179.027 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.24 -29.27 70.28 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.596 177.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.32 -43.9 54.78 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.523 -178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 -72.41 -49.38 34.1 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.027 -179.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.767 HG22 HH21 ' A' ' 94' ' ' ARG . 3.0 t -60.51 -41.16 86.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.65 -176.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 6.0 mttm -65.87 -27.6 68.34 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 -178.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.65 -26.08 68.51 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.062 0.458 . . . . 0.0 111.099 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.15 -31.58 72.84 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.423 -178.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.502 ' HD2' ' SD ' ' A' ' 24' ' ' MET . 2.4 pttt -75.03 -20.18 59.72 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.908 0.385 . . . . 0.0 111.614 179.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -23.55 57.47 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.418 -177.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -85.61 4.56 35.71 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -175.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -145.56 162.77 36.66 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.65 0.262 . . . . 0.0 110.829 178.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 20.8 t -77.29 113.01 15.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.811 -179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.655 ' HE2' ' HB3' ' A' ' 112' ' ' ASN . 0.3 OUTLIER -79.26 112.99 17.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.487 179.733 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.62 145.28 49.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.086 0.469 . . . . 0.0 110.52 -178.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.36 141.45 36.92 Favored Pre-proline 0 C--N 1.319 -0.747 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.168 179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.11 -22.72 5.54 Favored 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 124.07 3.18 . . . . 0.0 114.997 -174.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.509 ' HD2' ' HA ' ' A' ' 28' ' ' LYS . 2.1 mmmm -73.65 -44.14 57.63 Favored 'General case' 0 C--N 1.33 -0.271 0 O-C-N 121.825 -0.547 . . . . 0.0 110.891 177.385 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.555 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 10.5 t0 -72.7 -37.29 67.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.853 176.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.48 -46.72 84.88 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.15 178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.43 ' CE1' HG12 ' A' ' 59' ' ' VAL . 80.4 t80 -63.63 -42.8 98.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.804 -177.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -66.45 -41.54 88.97 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.405 -0.518 . . . . 0.0 111.813 -173.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 29' ' ' ASP . 0.3 OUTLIER -72.35 -27.38 62.38 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.598 176.082 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.611 HD11 ' HB2' ' A' ' 42' ' ' LEU . 1.9 mt -59.1 -50.56 73.59 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.767 177.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -76.26 -34.67 59.16 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.159 -177.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -70.47 -22.73 62.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.613 -177.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -115.81 140.28 25.95 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-O 121.06 0.457 . . . . 0.0 111.659 -177.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -82.82 -9.4 10.93 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.778 2.318 . . . . 0.0 111.579 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.503 ' HB3' ' HD2' ' A' ' 84' ' ' PRO . 0.1 OUTLIER -92.34 -67.02 0.88 Allowed 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.299 -179.632 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.753 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 52.3 mt -41.97 102.6 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.522 -0.125 0 CA-C-N 114.738 -1.119 . . . . 0.0 112.439 -175.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.797 HG21 ' HE2' ' A' ' 63' ' ' LYS . 26.4 m -101.85 145.09 29.68 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.748 -1.115 . . . . 0.0 110.271 179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.991 HD11 ' HB2' ' A' ' 88' ' ' PHE . 18.1 tp -104.16 127.18 51.74 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 175.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.799 HD11 HD11 ' A' ' 79' ' ' LEU . 4.5 mt -106.69 114.57 46.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 174.087 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.784 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -100.41 135.78 41.31 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.627 -177.671 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -114.68 96.77 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 121.994 0.902 . . . . 0.0 109.809 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.682 ' NE ' ' HA ' ' A' ' 46' ' ' ARG . 0.1 OUTLIER -143.4 142.52 31.27 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.747 -1.115 . . . . 0.0 108.611 177.468 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.499 ' HA ' ' NH2' ' A' ' 67' ' ' ARG . 5.9 m-20 -71.94 140.34 83.36 Favored Pre-proline 0 C--N 1.318 -0.762 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -174.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -52.76 -27.41 34.02 Favored 'Trans proline' 0 CA--C 1.528 0.199 0 C-N-CA 123.585 2.857 . . . . 0.0 114.362 -168.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.684 ' HB3' ' HB3' ' B' ' 49' ' ' ASP . 0.7 OUTLIER -79.92 -31.62 40.11 Favored 'General case' 0 C--N 1.324 -0.53 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.903 178.403 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.0 -36.92 72.64 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.982 0.42 . . . . 0.0 110.105 176.399 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.56 HD13 ' HB3' ' A' ' 46' ' ' ARG . 1.6 tp -60.65 -33.9 73.49 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.416 176.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.2 mttt -70.79 -38.59 73.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.261 177.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.83 -48.02 19.7 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.548 -174.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 21.8 mmm -102.64 -34.02 9.23 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.556 -173.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 121.61 179.63 16.06 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.299 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.477 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -132.81 150.98 77.22 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.422 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 37.9 Cg_exo -62.34 134.91 50.93 Favored 'Trans proline' 0 C--O 1.236 0.398 0 C-N-CA 122.514 2.143 . . . . 0.0 113.021 -176.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.475 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 26.9 t70 -101.26 92.35 4.92 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.699 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.726 HG22 ' HB2' ' A' ' 62' ' ' TYR . 5.3 m -133.63 159.31 42.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.068 177.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.4 mtpm? -57.35 -41.42 80.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.303 -177.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.536 ' HB2' ' HA ' ' A' ' 41' ' ' THR . 0.1 OUTLIER -121.4 82.33 1.92 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.745 -177.305 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.784 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 3.2 t80 -120.31 125.94 49.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.861 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.797 ' HE2' HG21 ' A' ' 41' ' ' THR . 11.3 mttm -122.13 120.62 34.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.016 0.436 . . . . 0.0 110.123 178.029 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.425 ' HD2' ' O ' ' A' ' 44' ' ' ASP . 12.9 t-160 -88.24 128.32 35.46 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.233 -178.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -126.56 171.97 10.64 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.075 0.465 . . . . 0.0 109.761 175.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.634 ' HA ' ' NH1' ' A' ' 67' ' ' ARG . 0.3 OUTLIER -101.01 -176.77 3.26 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 174.041 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.634 ' NH1' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -93.31 -62.87 1.29 Allowed 'General case' 0 C--N 1.324 -0.513 0 C-N-CA 120.457 -0.497 . . . . 0.0 109.913 179.854 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.734 ' CA ' ' HB2' ' B' ' 94' ' ' ARG . . . -91.35 6.71 80.84 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 121.11 -0.567 . . . . 0.0 112.163 176.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.609 ' HB3' ' CB ' ' A' ' 66' ' ' SER . 1.1 tppp? -124.54 13.2 8.73 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 177.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.603 HD21 ' CZ ' ' B' ' 11' ' ' PHE . 0.0 OUTLIER -72.09 -32.29 66.87 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 175.191 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.863 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 1.1 mt-10 -47.35 -62.08 2.36 Favored Pre-proline 0 CA--C 1.542 0.654 0 CA-C-N 115.276 -0.874 . . . . 0.0 111.162 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.863 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 3.4 Cg_exo -75.12 -17.36 19.36 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 122.493 2.129 . . . . 0.0 113.711 178.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.472 ' HB2' ' O ' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -90.0 -27.51 19.71 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -173.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.514 HD12 HD12 ' A' ' 79' ' ' LEU . 0.1 OUTLIER -69.52 -28.84 66.37 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.23 0.538 . . . . 0.0 110.384 -177.557 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.433 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -76.91 -33.26 57.77 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.224 173.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.651 ' HG3' ' O ' ' A' ' 72' ' ' PRO . 11.4 mttt -62.69 -29.77 70.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.86 -177.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -80.7 -41.07 24.29 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 120.695 0.283 . . . . 0.0 110.874 -177.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.49 52.07 2.07 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.684 -0.769 . . . . 0.0 111.582 -177.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.799 HD11 HD11 ' A' ' 43' ' ' ILE . 3.5 mt -75.81 143.58 41.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.407 0.146 . . . . 0.0 110.636 -178.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.484 ' HA ' ' HD3' ' A' ' 81' ' ' PRO . 0.0 OUTLIER -114.19 136.06 22.21 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 176.665 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 80' ' ' ASP . 25.6 Cg_exo -69.57 1.01 4.68 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.842 2.361 . . . . 0.0 114.06 -172.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.651 ' HA ' ' HD2' ' A' ' 108' ' ' LYS . 3.9 mt-10 -99.89 -7.1 25.7 Favored 'General case' 0 C--N 1.323 -0.554 0 O-C-N 121.996 -0.44 . . . . 0.0 110.715 178.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.445 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -84.19 118.65 71.77 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.277 177.485 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.753 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 8.4 Cg_exo -67.79 108.86 1.76 Allowed 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 122.45 2.1 . . . . 0.0 110.16 174.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.554 HG12 ' HB ' ' A' ' 41' ' ' THR . 9.0 m -114.64 154.15 16.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.292 0.568 . . . . 0.0 111.576 -172.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.536 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 1.5 p -123.85 142.56 40.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.264 177.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.856 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 6.0 m -108.46 126.09 65.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.991 ' HB2' HD11 ' A' ' 42' ' ' LEU . 3.7 t80 -100.83 126.21 47.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.947 -0.569 . . . . 0.0 112.062 -171.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' CYS . . . . . 0.776 ' HB2' ' O ' ' A' ' 88' ' ' PHE . 0.1 OUTLIER 102.61 95.73 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 O-C-N 124.957 1.411 . . . . 0.0 110.934 179.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.457 ' HG2' ' H ' ' A' ' 115' ' ' GLY . 0.2 OUTLIER -100.31 -34.09 10.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.771 -177.717 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.503 ' HB ' ' S4 ' ' A' ' 138' ' ' PS5 . 0.2 OUTLIER -79.59 -77.66 0.18 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.96 0.356 . . . . 0.0 111.96 -175.695 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.97 -56.17 25.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.714 0.292 . . . . 0.0 111.651 -176.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.776 ' HB3' ' HB3' ' A' ' 89' ' ' CYS . . . -76.2 -49.58 16.8 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -177.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.767 HH21 HG22 ' A' ' 15' ' ' VAL . 0.0 OUTLIER 74.19 70.58 0.11 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.715 0.634 . . . . 0.0 110.69 -174.795 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.856 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . -69.06 -2.51 10.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.328 -0.851 . . . . 0.0 112.672 -178.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -55.95 -29.57 60.36 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -71.16 -34.49 71.01 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 120.706 -0.398 . . . . 0.0 110.829 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.36 -40.89 61.82 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.915 0.388 . . . . 0.0 110.749 -179.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -81.42 -53.23 3.91 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.631 -0.795 . . . . 0.0 113.945 -175.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.435 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -61.49 -33.39 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 122.545 -0.385 . . . . 0.0 111.763 -172.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.435 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 3.5 m -71.55 -36.39 70.94 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.86 0.362 . . . . 0.0 110.921 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 102' ' ' LEU . 15.0 mt -69.92 -44.2 70.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.568 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.534 ' HA ' ' HB2' ' A' ' 107' ' ' PHE . 0.0 OUTLIER -63.91 -31.51 72.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.75 0.309 . . . . 0.0 110.735 -179.037 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -78.09 -5.22 50.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.262 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 12.9 m-30 -103.41 -10.51 18.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.052 177.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.21 1.27 3.24 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 119.753 -1.213 . . . . 0.0 113.93 174.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.534 ' HB2' ' HA ' ' A' ' 103' ' ' ARG . 8.0 m-85 -67.69 136.82 54.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 117.212 0.506 . . . . 0.0 110.403 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.651 ' HD2' ' HA ' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -67.12 -81.11 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.715 -174.327 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.412 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -112.19 113.59 25.92 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.825 -177.106 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.479 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 0.7 OUTLIER -117.23 127.7 74.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.212 0.529 . . . . 0.0 110.479 -179.67 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.536 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 13.6 m-85 -112.69 145.0 41.25 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.996 -176.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.655 ' HB3' ' HE2' ' A' ' 24' ' ' MET . 9.5 t-20 -112.0 136.68 51.03 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 172.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.533 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 16.4 m -91.73 117.63 29.93 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -172.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -55.94 121.6 9.67 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.733 177.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.457 ' H ' ' HG2' ' A' ' 90' ' ' LYS . . . 86.84 -108.34 3.32 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.983 -177.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.559 ' HA3' ' S1 ' ' A' ' 138' ' ' PS5 . . . 159.06 -154.83 25.9 Favored Glycine 0 N--CA 1.443 -0.885 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.034 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' MET . . . . . 0.438 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 16.7 ttp -50.67 -33.65 23.44 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.844 0.457 . . . . 0.0 111.748 -177.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.53 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 27.0 t70 -58.43 -40.37 82.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.084 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.4 mptt -73.96 -31.94 63.24 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.632 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.726 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 22.5 t-105 -59.51 -53.86 53.27 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.0 mt -65.23 -38.91 91.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.95 177.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -66.21 -44.8 82.84 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -176.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -81.78 20.03 1.0 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -175.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 65.66 24.8 71.36 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 121.251 -0.5 . . . . 0.0 113.153 176.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 120' ' ' TRP . 17.6 mt -83.44 152.05 63.37 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.852 0.358 . . . . 0.0 110.702 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.475 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 33.8 Cg_endo -66.01 118.71 5.73 Favored 'Trans proline' 0 C--O 1.236 0.386 0 C-N-CA 122.79 2.326 . . . . 0.0 112.835 -176.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -121.76 149.84 42.71 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.434 175.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.403 ' CB ' ' HD2' ' A' ' 56' ' ' LYS . 0.2 OUTLIER -102.61 124.9 48.99 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.514 -177.631 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -129.08 150.74 50.35 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.558 179.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 1.7 mtt180 -80.38 -30.12 37.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.014 0.435 . . . . 0.0 110.401 -179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -67.04 149.69 50.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.229 178.104 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 9.2 t-160 64.77 22.89 12.64 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.439 0.638 . . . . 0.0 110.423 -175.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -141.06 19.88 2.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.975 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 -135.68 36.33 2.89 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.396 -178.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -90.8 61.13 4.66 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.064 0.459 . . . . 0.0 110.261 176.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -175.23 164.26 3.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.233 -0.894 . . . . 0.0 109.391 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 9.8 t-160 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.261 -0.876 . . . . 0.0 109.87 176.561 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.678 0.275 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -88.73 162.93 15.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.883 176.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.85 10.07 22.47 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -175.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.612 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.14 -35.21 63.93 Favored Glycine 0 C--O 1.224 -0.476 0 CA-C-N 116.183 -0.462 . . . . 0.0 112.921 -179.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.64 -33.61 58.33 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.841 0.353 . . . . 0.0 111.258 178.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtt -68.19 -56.46 8.65 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.612 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 0.9 OUTLIER -74.46 -22.27 59.18 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.583 -177.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 1.1 t70 -53.11 -50.1 65.15 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.819 179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.21 -38.56 77.02 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.428 178.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -70.09 -46.4 64.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.925 0.393 . . . . 0.0 110.619 178.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' PHE . . . . . 0.603 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 0.9 OUTLIER -56.01 -48.85 75.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.451 -179.158 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' LYS . . . . . 0.621 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -62.47 -26.13 68.36 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.534 179.08 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.7 -44.4 56.6 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.068 0.461 . . . . 0.0 111.409 179.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.3 -49.83 31.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.902 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.9 t -64.09 -34.27 67.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.319 -175.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.621 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.3 OUTLIER -64.02 -27.89 69.42 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.552 0.215 . . . . 0.0 111.345 178.747 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.92 -25.57 68.2 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.94 0.4 . . . . 0.0 110.887 176.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.65 -32.5 64.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.882 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -78.15 -23.08 47.86 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.481 0.658 . . . . 0.0 110.366 171.939 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -76.58 -18.88 58.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.803 -179.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -79.89 -2.29 42.99 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.282 -179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.548 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 1.0 OUTLIER -139.63 172.72 12.38 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.928 0.394 . . . . 0.0 111.076 179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 17.6 t -82.09 112.44 19.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.729 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' MET . . . . . 0.634 ' SD ' ' HB3' ' B' ' 112' ' ' ASN . 0.0 OUTLIER -72.7 100.47 2.83 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.764 -0.198 . . . . 0.0 110.524 179.787 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' B' ' 113' ' ' SER . 1.2 mt -117.68 134.2 55.15 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.146 0.498 . . . . 0.0 110.449 -178.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.38 152.33 70.25 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.021 179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.567 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 6.9 Cg_endo -51.72 -20.93 10.3 Favored 'Trans proline' 0 CA--C 1.534 0.502 0 C-N-CA 123.661 2.907 . . . . 0.0 114.701 -174.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.497 ' HA ' ' HD2' ' B' ' 28' ' ' LYS . 5.8 mmmm -75.44 -48.01 24.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.102 0.477 . . . . 0.0 110.975 176.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.81 -31.37 64.77 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.689 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.14 -43.92 69.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.63 178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' TYR . . . . . 0.437 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 89.3 t80 -68.55 -31.7 71.11 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.065 -179.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -53.7 55.15 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.054 -179.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.513 HD13 HD13 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -74.46 -27.33 60.54 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.617 -0.265 . . . . 0.0 111.134 179.779 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.711 HD11 ' HB2' ' B' ' 42' ' ' LEU . 5.7 mt -57.74 -55.0 40.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.149 -0.478 . . . . 0.0 112.06 -177.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . 0.886 ' HA ' ' HD2' ' B' ' 60' ' ' LYS . 15.6 mm100 -74.59 -19.03 60.47 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.907 -174.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.3 -35.08 15.47 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.754 0.312 . . . . 0.0 111.478 -178.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 1.2 m-80 -92.43 127.33 49.09 Favored Pre-proline 0 C--N 1.324 -0.533 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -175.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -76.76 -9.55 18.33 Favored 'Trans proline' 0 N--CA 1.463 -0.308 0 C-N-CA 122.632 2.221 . . . . 0.0 111.285 174.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . 0.422 ' CG ' ' HG3' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -90.99 -69.45 0.73 Allowed 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 177.168 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.759 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 53.6 mt -44.11 109.75 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.833 -175.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.609 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -106.49 145.75 31.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 114.198 -1.365 . . . . 0.0 110.003 177.34 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.711 ' HB2' HD11 ' B' ' 34' ' ' LEU . 13.9 tp -102.44 124.41 47.97 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 96.4 mt -103.84 113.11 39.82 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.828 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 175.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.817 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -100.91 137.43 39.3 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.221 -177.434 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -115.34 97.19 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 121.87 0.843 . . . . 0.0 110.04 175.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . 0.633 HH21 ' HB2' ' B' ' 93' ' ' ALA . 0.8 OUTLIER -148.41 134.29 19.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.423 177.715 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.405 ' HA ' ' NH2' ' B' ' 67' ' ' ARG . 0.1 OUTLIER -69.83 147.63 96.2 Favored Pre-proline 0 C--N 1.318 -0.78 0 C-N-CA 120.356 -0.537 . . . . 0.0 111.056 -171.22 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -49.9 -32.74 31.14 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 124.055 3.17 . . . . 0.0 113.869 -172.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.684 ' HB3' ' HB3' ' A' ' 49' ' ' ASP . 0.4 OUTLIER -71.25 -43.05 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.724 0.297 . . . . 0.0 110.896 -179.407 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 49' ' ' ASP . 8.0 mt-10 -67.27 -36.97 82.67 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.7 176.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.408 ' CD1' ' HB3' ' B' ' 46' ' ' ARG . 0.5 OUTLIER -61.8 -34.58 76.15 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.796 177.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.4 mtmp? -72.79 -41.43 64.99 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.928 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.02 -48.47 16.09 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.533 0.568 . . . . 0.0 112.533 -173.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -99.48 -35.63 9.82 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.628 -173.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.62 -175.93 16.11 Favored Glycine 0 N--CA 1.446 -0.682 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.616 177.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.61 160.27 64.11 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.436 ' HB3' ' CZ2' ' B' ' 120' ' ' TRP . 25.5 Cg_exo -63.0 124.86 14.72 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.223 1.949 . . . . 0.0 112.913 -178.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . 0.827 ' HB3' ' HB2' ' B' ' 126' ' ' PRO . 25.6 t70 -90.35 88.06 7.05 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.013 176.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.596 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.6 m -134.98 167.51 25.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.886 ' HD2' ' HA ' ' B' ' 35' ' ' GLN . 0.0 OUTLIER -76.04 -27.84 57.45 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.929 0.395 . . . . 0.0 111.17 -176.88 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -122.65 68.77 0.97 Allowed 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.458 -175.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.817 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.3 t80 -121.79 127.49 50.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.816 0.341 . . . . 0.0 110.345 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.723 ' HD3' ' HB3' ' B' ' 77' ' ' SER . 61.8 mttm -122.83 122.33 38.41 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 177.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 13.8 t-160 -88.87 133.18 34.37 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.49 -177.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' MET . . . . . 0.536 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER -134.53 170.67 15.43 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.085 0.469 . . . . 0.0 110.796 179.319 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . 0.417 ' HA ' ' NH1' ' B' ' 67' ' ' ARG . 0.7 OUTLIER -91.6 -177.33 4.76 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.509 174.765 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' ARG . . . . . 0.417 ' NH1' ' HA ' ' B' ' 66' ' ' SER . 0.0 OUTLIER -90.73 -46.86 7.99 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 120.614 -0.434 . . . . 0.0 110.418 -177.531 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . 0.515 ' CA ' ' HD3' ' A' ' 94' ' ' ARG . . . -100.3 -44.22 2.22 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 175.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 5.4 tttt -77.79 29.18 0.16 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.145 0.498 . . . . 0.0 110.432 176.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.735 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER -76.31 -47.01 25.1 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.691 177.722 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.735 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -54.38 -46.56 98.99 Favored Pre-proline 0 CA--C 1.543 0.706 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -174.659 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.535 ' HD3' ' OE1' ' B' ' 71' ' ' GLU . 58.3 Cg_endo -71.18 -20.14 28.72 Favored 'Trans proline' 0 C--N 1.355 0.917 0 C-N-CA 121.333 1.355 . . . . 0.0 111.921 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.536 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -86.33 -26.47 24.86 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.189 0.518 . . . . 0.0 110.015 177.404 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.943 HD21 HD21 ' B' ' 102' ' ' LEU . 4.6 tp -58.0 -52.75 64.21 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.958 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.69 -28.49 68.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.636 -175.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -91.75 -13.48 31.51 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.361 -179.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' SER . . . . . 0.723 ' HB3' ' HD3' ' B' ' 63' ' ' LYS . 20.3 m -72.86 -27.67 62.06 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.897 0.38 . . . . 0.0 110.5 179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . 0.42 ' O ' ' HE3' ' B' ' 63' ' ' LYS . . . 90.77 64.02 1.21 Allowed Glycine 0 N--CA 1.447 -0.588 0 C-N-CA 120.764 -0.732 . . . . 0.0 112.433 179.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.2 mt -113.31 140.69 47.79 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.649 0.262 . . . . 0.0 110.406 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.87 ' HB3' ' HE3' ' B' ' 83' ' ' LYS . 3.3 t70 -114.55 133.03 22.58 Favored Pre-proline 0 C--N 1.323 -0.554 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.611 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 10.0 Cg_endo -57.6 -10.03 6.37 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.599 2.866 . . . . 0.0 115.266 -171.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.412 ' H ' ' HG3' ' B' ' 82' ' ' GLU . 0.0 OUTLIER -93.54 -10.53 34.52 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.679 -0.638 . . . . 0.0 110.924 179.825 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.87 ' HE3' ' HB3' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -78.7 121.2 83.26 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.534 -177.407 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.759 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 4.8 Cg_exo -72.87 117.47 5.14 Favored 'Trans proline' 0 N--CA 1.455 -0.792 0 C-N-CA 122.436 2.091 . . . . 0.0 109.984 173.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 12.3 m -121.1 158.24 23.88 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-O 121.313 0.578 . . . . 0.0 111.457 -174.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -120.97 140.6 44.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.955 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 1.8 m -110.84 122.48 65.42 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.122 0.487 . . . . 0.0 110.13 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.772 ' CZ ' ' HB2' ' B' ' 120' ' ' TRP . 0.3 OUTLIER -81.34 161.39 23.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.376 -175.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . 0.44 ' HB3' ' HB3' ' B' ' 93' ' ' ALA . 0.6 OUTLIER 65.98 88.34 0.11 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 171.751 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -100.99 -31.27 11.19 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 167.864 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' THR . . . . . 0.409 ' O ' ' HE3' ' A' ' 69' ' ' LYS . 0.1 OUTLIER -55.18 -52.09 64.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.257 -0.883 . . . . 0.0 112.337 -175.84 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.496 ' O ' ' HG2' ' A' ' 67' ' ' ARG . . . -103.56 -52.16 3.05 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.915 -0.314 . . . . 0.0 111.537 -178.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.633 ' HB2' HH21 ' B' ' 46' ' ' ARG . . . -76.62 -45.36 30.44 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -175.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' ARG . . . . . 0.734 ' HB2' ' CA ' ' A' ' 68' ' ' GLY . 5.6 ttp180 72.75 74.65 0.15 Allowed 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.577 0.704 . . . . 0.0 110.482 -170.96 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.955 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -67.06 -1.15 3.83 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.984 -1.007 . . . . 0.0 112.213 -179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.03 -29.36 63.31 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.787 -176.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' LEU . . . . . 0.467 HD13 ' HA ' ' B' ' 97' ' ' LEU . 2.4 mm? -76.98 -31.33 56.46 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.819 0.343 . . . . 0.0 110.879 177.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.88 -35.1 62.31 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.758 0.313 . . . . 0.0 111.025 -179.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -94.7 -54.92 1.47 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.443 -0.884 . . . . 0.0 114.273 -174.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.12 -28.44 67.87 Favored 'General case' 0 C--N 1.328 -0.36 0 O-C-N 122.399 -0.471 . . . . 0.0 111.981 -171.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -71.53 -35.83 70.82 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.892 0.377 . . . . 0.0 111.109 177.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.943 HD21 HD21 ' B' ' 74' ' ' LEU . 15.4 mt -63.81 -46.61 84.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.751 -178.519 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.554 ' HA ' ' HB2' ' B' ' 107' ' ' PHE . 0.0 OUTLIER -66.02 -26.86 67.72 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.833 0.349 . . . . 0.0 110.725 -179.215 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -71.02 -6.16 36.82 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.219 175.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -110.56 -9.2 14.57 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.221 179.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 130.28 5.18 4.28 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.918 -1.134 . . . . 0.0 113.58 175.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' PHE . . . . . 0.611 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 5.9 m-85 -66.05 135.35 54.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 117.177 0.489 . . . . 0.0 110.276 178.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 6.3 mttt -61.24 -84.38 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.563 -174.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.35 119.13 35.25 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.095 0.474 . . . . 0.0 110.837 -178.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' ILE . . . . . 0.486 HG21 ' HG2' ' B' ' 103' ' ' ARG . 0.4 OUTLIER -117.34 128.38 74.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.827 0 CA-C-O 121.177 0.513 . . . . 0.0 110.588 -178.192 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 1.2 m-85 -115.41 146.56 41.49 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.121 -175.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.634 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 4.5 t-20 -114.47 141.9 47.09 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 173.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.508 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 14.6 m -86.9 105.58 17.17 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.25 0.548 . . . . 0.0 111.611 -176.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.83 21.75 0.53 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.404 -0.816 . . . . 0.0 111.929 -177.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -116.44 -66.44 0.38 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.182 178.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 123.53 170.48 13.4 Favored Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.444 -178.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 117' ' ' MET . . . . . 0.526 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 1.0 OUTLIER -63.16 -34.71 78.21 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.021 0.439 . . . . 0.0 110.484 -179.549 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -62.1 -31.13 71.54 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.053 178.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 119' ' ' LYS . . . . . 0.567 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -72.81 -32.12 65.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.719 -0.219 . . . . 0.0 110.963 179.392 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.772 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.7 t-105 -60.21 -53.86 52.7 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 177.581 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' B' ' 121' ' ' LEU . 6.5 mt -63.93 -40.92 97.58 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.991 178.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -63.57 -43.85 95.82 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.885 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . 0.407 ' HB3' ' HD3' ' B' ' 28' ' ' LYS . 12.8 mm-40 -72.0 1.38 7.37 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.672 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.12 27.47 66.25 Favored Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.932 178.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . . . . . . . . . 85.5 mt -82.66 150.99 64.0 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.827 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 13.5 Cg_endo -57.68 128.39 29.02 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 123.084 2.522 . . . . 0.0 112.547 -176.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -116.81 142.97 46.23 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.294 -179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -97.66 101.73 13.32 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -129.35 145.03 51.45 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.817 -0.628 . . . . 0.0 109.979 -174.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -67.2 -30.12 69.97 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.531 0.197 . . . . 0.0 111.531 -177.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . 0.523 ' O ' ' HB2' ' B' ' 132' ' ' HIS . 0.7 OUTLIER -65.68 164.28 14.76 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.564 -0.289 . . . . 0.0 110.644 178.773 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 132' ' ' HIS . . . . . 0.523 ' HB2' ' O ' ' B' ' 131' ' ' SER . 22.1 m80 75.5 6.1 4.03 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.491 -172.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -133.14 -167.95 2.0 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.084 -0.962 . . . . 0.0 108.714 176.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 56.8 41.44 28.09 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.392 0.432 . . . . 0.0 111.178 176.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -87.12 -38.16 16.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.164 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 20.3 p-80 -111.25 132.54 54.27 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.076 176.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.369 -0.824 . . . . 0.0 109.504 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' PS5 . . . . . 0.559 ' S1 ' ' HA3' ' A' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 139' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.232 0 CA-C-O 121.277 0.561 . . . . 0.0 110.224 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 17.0 p-10 -149.5 52.88 0.94 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.819 0.818 . . . . 0.0 109.031 178.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.1 mpp? -77.05 10.95 2.02 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.892 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.738 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -53.52 -32.76 46.41 Favored Glycine 0 C--O 1.226 -0.402 0 CA-C-N 116.151 -0.477 . . . . 0.0 112.876 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -65.88 -32.55 74.12 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.994 0.425 . . . . 0.0 111.418 177.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.4 mmtm -69.79 -57.73 4.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.924 -175.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.738 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 4.9 p90 -77.79 -28.38 50.46 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 120.311 -0.556 . . . . 0.0 112.165 -174.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -53.93 -45.0 71.11 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.006 0.431 . . . . 0.0 110.563 -177.732 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.63 -41.85 95.7 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.226 177.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.18 -44.5 75.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.015 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -53.98 -46.84 71.79 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.264 0.554 . . . . 0.0 110.358 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -68.95 -26.53 65.11 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.466 178.235 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.86 -41.45 74.82 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.981 0.419 . . . . 0.0 110.602 177.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -71.32 -49.78 39.12 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.445 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.552 HG11 ' HG2' ' B' ' 71' ' ' GLU . 1.1 t -65.63 -35.77 76.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.951 -174.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.2 mttt -63.57 -30.2 71.35 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.803 0.335 . . . . 0.0 111.184 -179.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.82 -26.37 68.31 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.145 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.55 -32.94 64.45 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.97 -178.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -78.42 -23.43 46.69 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.382 0.611 . . . . 0.0 110.582 172.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -84.01 -18.17 38.01 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.29 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -69.38 -22.26 63.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.889 -175.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.618 ' HE3' HG12 ' A' ' 110' ' ' ILE . 4.3 ptm -127.43 179.55 5.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.668 0.271 . . . . 0.0 111.018 -178.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 21.5 t -80.14 108.24 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.471 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.13 121.6 25.76 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.944 0.402 . . . . 0.0 110.644 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 113' ' ' SER . 3.6 mt -134.73 143.61 47.27 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.065 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -74.98 141.88 75.48 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 116.272 -0.422 . . . . 0.0 109.888 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.652 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 5.8 Cg_endo -49.83 -22.92 7.84 Favored 'Trans proline' 0 CA--C 1.532 0.41 0 C-N-CA 123.825 3.017 . . . . 0.0 114.331 -175.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.67 -45.83 41.94 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.076 -0.39 . . . . 0.0 110.642 174.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -68.32 -29.49 68.26 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.195 176.422 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.61 -46.06 49.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.779 178.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.608 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 66.5 t80 -66.26 -28.53 68.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.808 0.337 . . . . 0.0 110.768 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -53.58 56.78 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.904 179.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.517 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -73.43 -27.39 61.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.711 178.261 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.625 HD11 ' HB2' ' A' ' 42' ' ' LEU . 1.1 mt -60.71 -55.25 35.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.204 179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -74.0 -26.75 60.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.028 -176.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -79.08 -40.11 32.07 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.934 0.397 . . . . 0.0 110.584 -179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 15.2 m-80 -118.78 100.51 50.97 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.669 -176.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -68.13 5.08 1.25 Allowed 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.977 2.451 . . . . 0.0 112.394 178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.73 -33.12 23.16 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.552 174.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.689 HG12 ' HB2' ' A' ' 84' ' ' PRO . 13.9 mt -86.63 106.93 16.27 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.412 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.389 177.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.501 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -95.65 146.41 24.51 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.686 -179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.625 ' HB2' HD11 ' A' ' 34' ' ' LEU . 7.9 tp -98.45 127.62 44.46 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 174.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 83.1 mt -111.86 121.85 65.11 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 177.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -109.3 148.14 31.52 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.226 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.39 98.82 5.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.542 176.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.413 ' HA ' ' HD2' ' A' ' 46' ' ' ARG . 8.5 mmm-85 -156.28 -170.81 3.48 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.669 178.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.43 ' HB3' ' HG3' ' A' ' 50' ' ' GLU . 3.9 t70 -100.02 129.2 28.92 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.843 0.354 . . . . 0.0 110.268 176.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -62.05 -19.34 65.91 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.684 2.256 . . . . 0.0 113.086 -178.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -72.01 -51.26 22.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.779 0.324 . . . . 0.0 111.061 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.49 ' HB3' ' CB ' ' B' ' 49' ' ' ASP . 0.2 OUTLIER -73.16 -27.6 61.74 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.338 177.137 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.493 HD22 ' CE1' ' A' ' 64' ' ' HIS . 0.7 OUTLIER -58.98 -46.69 87.5 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.111 174.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.01 -30.89 71.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.72 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -82.29 -48.3 11.38 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 36.6 mtm -92.24 -34.45 14.26 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 -171.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 139.19 146.12 4.87 Favored Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.541 179.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.44 141.52 40.7 Favored Pre-proline 0 C--N 1.326 -0.429 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 177.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.425 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 9.4 Cg_endo -56.98 121.9 10.88 Favored 'Trans proline' 0 C--N 1.343 0.255 0 C-N-CA 122.547 2.165 . . . . 0.0 112.438 -177.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -93.22 93.38 8.21 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.281 178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.686 HG22 ' HB2' ' A' ' 62' ' ' TYR . 15.9 m -132.07 162.48 39.56 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.356 176.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -37.31 83.44 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.691 -177.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.501 ' HB2' HG23 ' A' ' 41' ' ' THR . 19.4 p-10 -128.75 79.9 1.94 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.571 0.7 . . . . 0.0 111.286 -174.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.686 ' HB2' HG22 ' A' ' 59' ' ' VAL . 9.3 t80 -122.3 129.86 52.59 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.279 179.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.467 ' HD2' ' HB2' ' A' ' 77' ' ' SER . 0.0 OUTLIER -125.07 122.39 37.06 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.183 0.516 . . . . 0.0 110.934 178.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.493 ' CE1' HD22 ' A' ' 51' ' ' LEU . 2.7 t-160 -92.0 116.95 29.36 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.426 177.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.918 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -118.05 102.58 9.14 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.655 0.264 . . . . 0.0 110.791 -176.747 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.44 ' HB2' ' H ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -94.88 -103.37 0.15 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.976 -174.279 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.682 ' HG2' ' HG2' ' A' ' 72' ' ' PRO . 0.4 OUTLIER 56.6 -139.42 0.92 Allowed 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 -173.188 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.669 ' HA2' HG22 ' B' ' 91' ' ' THR . . . -89.25 -44.27 5.06 Favored Glycine 0 N--CA 1.444 -0.827 0 C-N-CA 119.599 -1.286 . . . . 0.0 110.574 174.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.538 ' HG2' ' HD2' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -151.73 45.04 0.77 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.785 -0.208 . . . . 0.0 110.849 174.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.918 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 68.43 -12.93 0.32 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 171.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.605 ' CD ' ' HD3' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -44.67 -58.5 5.22 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 -173.443 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.682 ' HG2' ' HG2' ' A' ' 67' ' ' ARG . 13.3 Cg_exo -73.16 -16.95 25.01 Favored 'Trans proline' 0 C--N 1.355 0.886 0 C-N-CA 122.079 1.853 . . . . 0.0 113.209 -175.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.741 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -96.46 -15.33 21.78 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.651 0.262 . . . . 0.0 110.685 -179.033 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.736 HD13 HD11 ' A' ' 70' ' ' LEU . 30.6 tp -58.16 -54.95 41.16 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.168 -179.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -63.76 -16.41 61.09 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.838 -179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.1 mmmt -88.58 -17.9 29.2 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 -175.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.467 ' HB2' ' HD2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -100.84 43.85 1.04 Allowed 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.988 -0.285 . . . . 0.0 111.766 -175.664 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 43.47 64.7 1.73 Allowed Glycine 0 C--N 1.335 0.477 0 O-C-N 123.616 0.573 . . . . 0.0 113.459 175.667 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.499 HD13 HD12 ' A' ' 74' ' ' LEU . 8.0 mt -116.32 128.64 55.73 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.131 0.491 . . . . 0.0 111.033 -177.591 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -129.82 149.93 74.44 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.164 -0.926 . . . . 0.0 108.809 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -71.36 17.75 0.28 Allowed 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 122.889 2.393 . . . . 0.0 113.59 -174.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.21 6.17 10.75 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.083 0.468 . . . . 0.0 110.179 176.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.454 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 3.1 mttm -106.88 133.8 20.12 Favored Pre-proline 0 C--N 1.325 -0.47 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.642 -178.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.689 ' HB2' HG12 ' A' ' 40' ' ' ILE . 2.5 Cg_endo -77.74 141.54 19.51 Favored 'Trans proline' 0 N--CA 1.454 -0.837 0 C-N-CA 122.732 2.288 . . . . 0.0 110.721 175.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.521 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -143.93 148.32 18.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 120.834 0.349 . . . . 0.0 110.624 -177.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.4 p -123.86 140.05 48.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 175.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.981 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 13.3 m -108.57 134.72 49.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.345 -176.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.834 ' CZ ' ' HB2' ' A' ' 120' ' ' TRP . 1.4 t80 -101.06 162.68 12.72 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.225 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' CYS . . . . . 0.548 ' HA ' ' HA2' ' A' ' 116' ' ' GLY . 0.1 OUTLIER 68.49 109.5 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 113.135 0.791 . . . . 0.0 113.135 174.303 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.685 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -136.23 18.52 3.18 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.239 175.644 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.73 22.49 15.85 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -177.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -174.29 -66.07 0.01 OUTLIER 'General case' 0 C--O 1.233 0.185 0 CA-C-O 121.171 0.51 . . . . 0.0 110.438 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.492 ' O ' ' HB2' ' A' ' 94' ' ' ARG . . . -74.44 -45.89 43.51 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.589 179.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.788 ' HG3' ' HG2' ' B' ' 69' ' ' LYS . 0.0 OUTLIER 75.69 91.15 0.08 Allowed 'General case' 0 N--CA 1.465 0.276 0 O-C-N 124.096 0.873 . . . . 0.0 111.011 -179.809 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.981 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . -66.27 -2.87 4.82 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.941 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -57.84 -31.91 67.1 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.697 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -66.64 -33.69 76.21 Favored 'General case' 0 C--O 1.223 -0.326 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.616 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.18 -49.73 18.54 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.039 0.447 . . . . 0.0 110.913 178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.422 ' HA3' ' CE ' ' A' ' 22' ' ' MET . . . -75.79 -51.69 6.93 Favored Glycine 0 N--CA 1.449 -0.486 0 CA-C-N 115.46 -0.791 . . . . 0.0 114.127 -173.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.443 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -65.33 -30.57 71.43 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.914 0.387 . . . . 0.0 111.056 -174.282 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.482 HG22 ' CE2' ' A' ' 105' ' ' TYR . 32.7 m -72.16 -36.75 69.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.912 176.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.53 HD21 HD21 ' A' ' 74' ' ' LEU . 8.1 mt -68.05 -42.91 79.81 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.517 179.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.443 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 4.0 ptm180 -67.7 -27.24 66.66 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.849 0.357 . . . . 0.0 110.361 179.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.427 ' CD ' ' HZ1' ' A' ' 100' ' ' LYS . 0.5 OUTLIER -69.75 -6.91 35.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.361 174.644 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.522 ' CE1' ' HB ' ' B' ' 10' ' ' THR . 22.5 m-85 -107.4 -12.11 15.39 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.683 0.278 . . . . 0.0 110.762 178.485 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.46 50.98 0.73 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.523 -0.846 . . . . 0.0 113.323 173.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.459 ' CE1' HD22 ' A' ' 102' ' ' LEU . 2.0 m-85 -88.43 -179.84 6.17 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 122.679 -0.307 . . . . 0.0 110.584 177.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 5.4 mttt -85.46 -97.02 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.655 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.19 115.91 29.59 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.742 0.305 . . . . 0.0 110.554 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.618 HG12 ' HE3' ' A' ' 22' ' ' MET . 1.5 tt -118.05 127.72 75.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.068 0.461 . . . . 0.0 110.743 -176.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -115.62 144.95 43.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.625 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.582 ' HB2' ' HG3' ' A' ' 22' ' ' MET . 4.1 t-20 -107.87 136.14 48.08 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 171.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.479 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.1 m -88.45 108.76 19.55 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.704 0.287 . . . . 0.0 111.759 -175.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -58.89 135.59 57.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.296 178.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.621 ' O ' ' HG3' ' A' ' 90' ' ' LYS . . . 93.1 -106.88 3.47 Favored Glycine 0 N--CA 1.443 -0.868 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.75 -174.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.584 ' H ' ' HB2' ' A' ' 119' ' ' LYS . . . 160.79 -156.97 28.41 Favored Glycine 0 N--CA 1.449 -0.492 0 N-CA-C 111.472 -0.651 . . . . 0.0 111.472 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' MET . . . . . 0.472 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 2.2 ttm -59.02 -33.68 71.02 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.203 0.525 . . . . 0.0 109.987 177.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.496 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.8 OUTLIER -61.73 -32.28 72.5 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.014 177.205 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.652 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -74.6 -32.75 62.46 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 122.168 0.187 . . . . 0.0 111.476 178.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.834 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 24.8 t-105 -59.83 -53.32 59.35 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 178.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 121' ' ' LEU . 5.5 mt -64.84 -38.94 92.67 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.967 177.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.7 OUTLIER -65.51 -35.77 81.85 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-O 120.873 0.368 . . . . 0.0 111.483 -178.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.722 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.0 tp10 -79.43 -3.89 48.62 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.612 -178.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.3 29.18 68.74 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 121.056 -0.593 . . . . 0.0 112.041 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.722 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 52.3 mt -80.94 160.65 65.69 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-O 120.679 0.276 . . . . 0.0 110.879 -176.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 21.0 Cg_endo -58.47 117.58 4.32 Favored 'Trans proline' 0 C--N 1.342 0.233 0 C-N-CA 123.079 2.519 . . . . 0.0 112.47 -179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 1.4 m -128.44 146.39 50.82 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 177.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 3.2 mt -99.36 103.1 14.88 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.077 0.465 . . . . 0.0 110.105 178.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -115.7 142.21 47.05 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.463 -0.789 . . . . 0.0 109.676 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.66 79.08 2.21 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 176.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.83 113.86 1.02 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.965 -1.016 . . . . 0.0 112.646 -170.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -97.69 86.66 3.86 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 173.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -75.9 -8.83 57.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.661 -173.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 14.5 t60 -67.69 -29.45 68.72 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.747 0.308 . . . . 0.0 110.775 -179.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -78.54 80.13 4.93 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.183 0.516 . . . . 0.0 111.443 -178.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 50.1 p-80 -86.26 -20.04 29.05 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.63 171.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 46.9 t60 . . . . . 0 C--O 1.25 1.099 0 CA-C-O 117.153 -1.403 . . . . 0.0 107.327 176.826 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.087 0 CA-C-O 121.406 0.622 . . . . 0.0 109.953 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -138.24 65.29 1.47 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.274 -0.876 . . . . 0.0 109.362 -176.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' MET . . . . . 0.552 ' HG3' ' HG3' ' B' ' 6' ' ' LYS . 1.9 mpp? -78.82 2.88 18.41 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.279 -175.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.715 ' HA2' ' CE1' ' B' ' 7' ' ' PHE . . . -56.31 -39.24 81.9 Favored Glycine 0 N--CA 1.448 -0.524 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.633 177.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -63.48 -33.04 74.71 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.299 -0.451 . . . . 0.0 111.421 176.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.552 ' HG3' ' HG3' ' B' ' 3' ' ' MET . 1.7 mmmt -71.27 -52.24 20.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.626 -175.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.715 ' CE1' ' HA2' ' B' ' 4' ' ' GLY . 2.2 p90 -82.41 -24.31 34.44 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 119.931 -0.708 . . . . 0.0 112.267 -175.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -52.92 -49.49 65.87 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 120.777 0.322 . . . . 0.0 110.683 -179.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.67 -44.71 77.54 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.255 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . 0.522 ' HB ' ' CE1' ' A' ' 105' ' ' TYR . 0.0 OUTLIER -64.89 -42.86 94.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.938 179.132 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' PHE . . . . . 0.468 ' O ' ' HB ' ' B' ' 15' ' ' VAL . 0.5 OUTLIER -57.85 -47.96 81.17 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.013 0.435 . . . . 0.0 110.428 179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' LYS . . . . . 0.607 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.41 -25.9 68.22 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.185 177.597 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.21 -47.53 27.81 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.101 0.477 . . . . 0.0 111.262 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -70.89 -50.37 35.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.688 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.505 HG13 HH22 ' B' ' 94' ' ' ARG . 0.5 OUTLIER -60.2 -33.01 52.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.633 -176.791 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.607 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.1 OUTLIER -70.8 -38.9 73.34 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-O 120.594 0.235 . . . . 0.0 110.978 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.08 -25.82 64.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.493 -178.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.27 -40.34 81.92 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.683 -179.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' B' ' 16' ' ' LYS . 4.9 pttp -77.62 -22.0 51.44 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.293 0.568 . . . . 0.0 110.865 174.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -78.79 -19.48 52.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.483 -0.78 . . . . 0.0 111.54 -178.487 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' B' ' 100' ' ' LYS . 25.4 t70 -69.18 -25.84 64.55 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.751 -175.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.434 ' CE ' ' HA3' ' B' ' 99' ' ' GLY . 12.4 ptm -117.49 179.87 3.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.814 0.34 . . . . 0.0 111.708 -177.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 34.8 t -76.61 113.64 15.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.527 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.04 112.67 21.47 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.896 -177.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.523 HD23 ' HA ' ' B' ' 25' ' ' LEU . 4.1 mt -112.39 -169.09 1.41 Allowed 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.02 179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.69 144.65 47.11 Favored Pre-proline 0 C--N 1.317 -0.848 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 173.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_endo -50.0 -25.14 11.92 Favored 'Trans proline' 0 CA--C 1.531 0.335 0 C-N-CA 123.554 2.836 . . . . 0.0 113.581 -176.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.86 -43.22 59.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.969 0.414 . . . . 0.0 110.72 176.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . 0.464 ' HB3' HD13 ' B' ' 25' ' ' LEU . 0.2 OUTLIER -73.89 -32.97 63.85 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.95 178.462 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.617 ' HB1' HG21 ' B' ' 86' ' ' VAL . . . -66.69 -47.33 72.75 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.734 178.221 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' TYR . . . . . 0.618 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 71.5 t80 -67.92 -30.53 69.87 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.876 -0.33 . . . . 0.0 110.811 179.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -55.73 -53.1 60.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.946 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.571 ' O ' ' HB2' ' B' ' 37' ' ' ASN . 0.2 OUTLIER -74.36 -27.05 60.49 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.813 178.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.7 HD11 ' HB2' ' B' ' 42' ' ' LEU . 2.9 mt -60.46 -55.9 27.94 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.024 0.44 . . . . 0.0 111.797 -178.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -76.03 -19.12 58.92 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.103 -0.499 . . . . 0.0 112.02 -173.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.2 -16.72 18.45 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.486 -178.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.571 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 10.6 m-80 -121.32 101.24 44.22 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 110.139 -0.319 . . . . 0.0 110.139 178.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_exo -66.2 -5.51 12.61 Favored 'Trans proline' 0 C--O 1.233 0.252 0 C-N-CA 123.161 2.574 . . . . 0.0 113.416 -176.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . 0.422 ' CG ' ' HZ2' ' B' ' 83' ' ' LYS . 0.3 OUTLIER -98.28 -19.67 17.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.745 0.307 . . . . 0.0 110.84 178.37 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.628 ' HA ' ' O ' ' B' ' 84' ' ' PRO . 26.5 mt -82.68 105.24 12.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.283 -0.417 . . . . 0.0 109.926 176.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.672 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -98.72 145.18 27.17 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.05 -176.615 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.957 HD11 ' HB2' ' B' ' 88' ' ' PHE . 12.7 tp -100.91 125.18 47.45 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 175.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 2.0 mt -105.55 115.57 47.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 175.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.757 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -101.26 133.66 45.5 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.421 ' O ' ' HB3' ' B' ' 93' ' ' ALA . 0.1 OUTLIER -126.78 98.96 5.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 115.099 -0.955 . . . . 0.0 108.599 -179.693 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . 0.416 ' HG3' ' N ' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -160.16 154.93 24.23 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.314 -174.252 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' B' ' 46' ' ' ARG . 0.0 OUTLIER -59.74 144.89 84.75 Favored Pre-proline 0 CA--C 1.535 0.399 0 CA-C-O 120.986 0.422 . . . . 0.0 111.241 -178.835 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -70.06 -18.54 35.55 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 123.322 2.681 . . . . 0.0 114.01 -176.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.49 ' CB ' ' HB3' ' A' ' 50' ' ' GLU . 1.0 OUTLIER -74.89 -42.65 57.42 Favored 'General case' 0 CA--C 1.51 -0.568 0 O-C-N 121.867 -0.521 . . . . 0.0 111.296 -178.052 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -66.53 -35.09 79.39 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 179.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.799 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.4 mp -56.68 -34.17 67.12 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.417 176.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 mtpt -79.31 -41.13 28.69 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.032 178.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.24 -48.06 13.65 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.476 -172.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -97.7 -34.32 10.97 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.755 0.312 . . . . 0.0 110.795 -176.838 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.68 176.42 14.94 Favored Glycine 0 N--CA 1.444 -0.768 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.009 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' LYS . . . . . 0.799 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.1 OUTLIER -134.67 151.33 75.68 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 178.054 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_endo -57.18 125.96 20.6 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 122.762 2.308 . . . . 0.0 112.671 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . 0.808 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 7.4 t0 -100.37 91.47 4.73 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.335 178.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.521 HG23 ' H ' ' B' ' 61' ' ' ASN . 2.8 m -128.49 166.39 25.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 176.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.13 -29.14 67.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.824 0.345 . . . . 0.0 111.239 -176.177 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.588 ' HB2' HG23 ' B' ' 41' ' ' THR . 5.1 p30 -131.22 77.48 1.78 Allowed 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.723 -0.672 . . . . 0.0 111.261 -173.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.757 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 0.6 OUTLIER -130.42 141.01 50.55 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.961 178.165 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.672 ' HE2' HG21 ' B' ' 41' ' ' THR . 0.0 OUTLIER -135.31 135.41 40.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.86 0.362 . . . . 0.0 110.675 175.65 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 4.8 t-160 -88.69 118.64 28.51 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' MET . . . . . 0.467 ' HB3' ' HB2' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -109.08 91.49 3.66 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.328 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -115.9 77.32 1.08 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.061 0.458 . . . . 0.0 111.609 -173.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' ARG . . . . . 0.858 ' HG2' ' HG2' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -105.5 -136.47 0.35 Allowed 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 171.765 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -81.45 -44.11 8.13 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 119.145 -1.502 . . . . 0.0 109.68 169.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' LYS . . . . . 0.904 ' HA ' ' HE3' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -146.7 44.8 1.19 Allowed 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.553 -0.823 . . . . 0.0 108.996 171.001 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.535 HD12 HD13 ' B' ' 74' ' ' LEU . 0.5 OUTLIER 55.73 0.42 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 125.162 1.385 . . . . 0.0 114.432 177.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.694 ' HB2' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -45.94 -66.1 0.56 Allowed Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 -174.46 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.858 ' HG2' ' HG2' ' B' ' 67' ' ' ARG . 55.3 Cg_endo -74.43 -15.13 22.42 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 121.99 1.794 . . . . 0.0 113.79 -177.128 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.477 HD22 ' HA ' ' B' ' 73' ' ' LEU . 0.1 OUTLIER -83.04 -15.11 52.32 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.878 0.37 . . . . 0.0 110.555 -179.218 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.964 HD21 HD21 ' B' ' 102' ' ' LEU . 9.0 tp -58.51 -53.84 53.8 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.975 -179.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -68.09 -24.94 65.1 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.768 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -77.73 -25.98 49.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.745 -175.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 1.4 m -106.31 43.99 1.09 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 -173.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 44.75 77.77 0.09 OUTLIER Glycine 0 C--N 1.336 0.566 0 N-CA-C 114.495 0.558 . . . . 0.0 114.495 172.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.426 HD21 ' HE3' ' B' ' 63' ' ' LYS . 53.3 mt -127.59 136.19 51.33 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.711 0.255 . . . . 0.0 110.697 177.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.475 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 3.5 t0 -135.47 136.63 24.43 Favored Pre-proline 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.597 . . . . 0.0 109.624 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.562 ' HD3' ' HE2' ' A' ' 7' ' ' PHE . 32.9 Cg_exo -63.35 11.82 0.09 OUTLIER 'Trans proline' 0 CA--C 1.537 0.633 0 C-N-CA 123.542 2.828 . . . . 0.0 114.828 -173.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.95 -8.53 17.57 Favored 'General case' 0 C--N 1.323 -0.574 0 O-C-N 121.778 -0.576 . . . . 0.0 110.492 175.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.8 mttp -90.93 134.18 30.75 Favored Pre-proline 0 C--N 1.326 -0.417 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.751 -176.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.628 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 1.3 Cg_endo -78.6 121.82 5.28 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.756 2.304 . . . . 0.0 110.198 171.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.531 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.1 OUTLIER -127.23 151.68 34.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 120.959 0.409 . . . . 0.0 111.177 -174.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.617 HG21 ' HB1' ' B' ' 30' ' ' ALA . 1.4 p -125.18 140.19 48.95 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 177.013 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.934 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 16.6 m -108.25 137.77 38.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.342 -178.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.957 ' HB2' HD11 ' B' ' 42' ' ' LEU . 8.3 t80 -120.19 143.9 47.99 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.575 -175.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . 0.403 ' SG ' ' HB2' ' B' ' 46' ' ' ARG . 0.1 OUTLIER 78.12 76.41 0.06 Allowed 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.824 0.703 . . . . 0.0 111.31 -177.636 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.669 ' HA ' ' H ' ' B' ' 95' ' ' ALA . 0.3 OUTLIER -89.43 11.74 18.42 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.698 -179.275 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' THR . . . . . 0.669 HG22 ' HA2' ' A' ' 68' ' ' GLY . 0.2 OUTLIER -98.62 -88.67 0.32 Allowed 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.221 0.452 . . . . 0.0 112.221 -174.817 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -50.92 -72.65 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -175.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' B' ' 45' ' ' VAL . . . -75.28 -27.25 59.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.671 0.272 . . . . 0.0 110.488 178.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' ARG . . . . . 0.538 ' HD2' ' HG2' ' A' ' 69' ' ' LYS . 0.0 OUTLIER 71.61 85.91 0.12 Allowed 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.45 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.934 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -61.22 -12.89 14.71 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.995 179.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.05 -32.19 69.54 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 116.609 -0.268 . . . . 0.0 111.101 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -73.44 -26.94 61.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.858 0.361 . . . . 0.0 110.633 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.65 -44.63 56.35 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.007 0.432 . . . . 0.0 110.691 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 99' ' ' GLY . . . . . 0.434 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -85.32 -45.46 5.86 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.637 -0.792 . . . . 0.0 114.061 -173.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 100' ' ' LYS . . . . . 0.482 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -64.71 -34.77 79.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.99 0.424 . . . . 0.0 111.19 -174.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . 0.482 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 3.9 m -72.56 -35.43 67.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.179 177.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.964 HD21 HD21 ' B' ' 74' ' ' LEU . 8.1 mt -67.04 -42.98 83.92 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -177.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.457 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -65.45 -26.59 68.02 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.08 0.467 . . . . 0.0 110.211 178.5 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -72.02 -7.38 48.44 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.701 177.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . 0.428 ' CE2' HG22 ' B' ' 101' ' ' THR . 22.4 m-85 -108.21 -17.55 13.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.634 0.254 . . . . 0.0 110.876 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 121.73 29.05 1.46 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 119.987 -1.101 . . . . 0.0 113.351 173.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' PHE . . . . . 0.513 ' CE1' HD22 ' B' ' 102' ' ' LEU . 2.7 m-85 -74.36 154.97 38.62 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 175.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . 0.443 ' HB3' ' H ' ' B' ' 109' ' ' THR . 2.0 tttt -66.75 -92.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.065 0.459 . . . . 0.0 111.278 -174.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.443 ' H ' ' HB3' ' B' ' 108' ' ' LYS . 0.2 OUTLIER -115.28 110.89 20.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.27 -178.935 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' ILE . . . . . 0.531 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.3 tt -112.23 128.58 68.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 121.035 0.445 . . . . 0.0 110.49 -177.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -117.77 148.13 42.34 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.734 -174.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -116.77 141.58 48.02 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 175.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 16.1 m -91.1 107.44 19.2 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -175.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.48 158.13 34.45 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.021 0.438 . . . . 0.0 110.748 176.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 90.74 -78.71 1.43 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.76 -178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . 0.497 ' HA3' ' S5 ' ' B' ' 139' ' ' PS5 . . . 142.27 -170.12 25.14 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.164 178.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 117' ' ' MET . . . . . 0.597 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 4.0 tpp -66.11 -30.28 70.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 110.32 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.568 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -60.28 -32.28 71.04 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.971 179.549 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 119' ' ' LYS . . . . . 0.407 ' HD2' ' OD1' ' B' ' 118' ' ' ASP . 0.0 OUTLIER -69.64 -32.61 71.39 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 111.747 0.277 . . . . 0.0 111.747 -179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.788 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 18.2 t-105 -60.23 -54.86 40.71 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.256 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 7.1 mt -66.95 -39.39 87.27 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.127 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.568 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.9 OUTLIER -63.69 -43.41 96.69 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.799 -176.885 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . 0.474 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 3.1 tp10 -75.7 -2.95 31.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.25 -178.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.35 30.4 60.6 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.761 -0.733 . . . . 0.0 111.799 179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.474 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 52.2 mt -76.64 157.7 81.84 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.532 ' HG3' ' CZ ' ' B' ' 31' ' ' TYR . 25.2 Cg_endo -61.52 120.54 8.24 Favored 'Trans proline' 0 C--O 1.234 0.304 0 C-N-CA 122.849 2.366 . . . . 0.0 112.25 -177.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.22 144.54 38.52 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 178.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 128' ' ' LEU . . . . . 0.808 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 19.8 mt -93.6 101.32 13.48 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 176.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -125.0 137.17 54.25 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.766 -176.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.75 78.16 4.25 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 174.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.5 m -36.31 120.11 0.64 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 114.154 -1.385 . . . . 0.0 112.606 -171.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -72.56 55.19 0.35 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.871 -1.059 . . . . 0.0 111.905 -173.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -89.38 44.79 1.23 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.09 0.472 . . . . 0.0 110.417 177.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 14.3 t60 -124.85 22.31 8.13 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.129 178.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -110.58 98.47 7.65 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.153 0.502 . . . . 0.0 110.357 177.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -78.33 -22.92 47.36 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.141 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 3.1 t60 . . . . . 0 C--O 1.247 0.961 0 CA-C-O 118.05 -0.976 . . . . 0.0 109.4 176.82 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' PS5 . . . . . 0.405 ' S3 ' ' HB3' ' A' ' 117' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 139' ' ' PS5 . . . . . 0.497 ' S5 ' ' HA3' ' B' ' 116' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 120.666 0.27 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -151.88 5.55 0.43 Allowed 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -178.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.59 7.99 2.62 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.858 0.361 . . . . 0.0 111.668 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.794 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -50.45 -24.97 7.94 Favored Glycine 0 CA--C 1.524 0.618 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.513 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.7 -31.91 68.95 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.901 0.381 . . . . 0.0 111.218 177.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mmtp -64.98 -57.24 9.23 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.098 -175.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.794 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.2 p90 -76.28 -21.23 56.53 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.391 -176.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.602 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 0.7 OUTLIER -52.44 -49.81 63.85 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.348 0.405 . . . . 0.0 110.301 -178.328 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.78 -43.81 85.82 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.458 178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -66.5 -45.3 80.05 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.267 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.516 ' CD2' HD22 ' B' ' 74' ' ' LEU . 0.9 OUTLIER -58.97 -47.28 85.69 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.147 0.498 . . . . 0.0 110.277 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.501 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.2 OUTLIER -64.91 -26.64 68.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.289 178.024 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.04 -41.89 61.1 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.0 0.428 . . . . 0.0 111.618 179.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -71.09 -49.82 40.35 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.625 179.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.3 t -63.01 -34.86 68.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.379 -177.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.4 OUTLIER -68.86 -35.21 76.63 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.646 0.26 . . . . 0.0 111.25 178.524 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.99 -26.06 65.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.643 -178.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.0 -35.66 75.53 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.501 ' HA ' ' SD ' ' A' ' 22' ' ' MET . 0.8 OUTLIER -74.64 -19.23 60.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.946 0.403 . . . . 0.0 111.658 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -74.24 -24.81 59.36 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.474 -178.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.401 ' O ' ' HD3' ' A' ' 103' ' ' ARG . 8.8 t70 -87.47 17.86 4.25 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.915 0.388 . . . . 0.0 111.943 -175.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.501 ' SD ' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -144.79 165.2 28.76 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 122.121 -0.362 . . . . 0.0 111.462 179.294 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.1 t -84.03 104.51 12.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.544 174.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.649 ' HB3' ' HG2' ' A' ' 114' ' ' GLU . 0.7 OUTLIER -82.6 114.05 20.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.212 0.529 . . . . 0.0 110.85 -175.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.469 ' HA ' HD23 ' A' ' 25' ' ' LEU . 3.3 mt -122.98 147.05 47.07 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.252 -179.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.6 142.9 78.1 Favored Pre-proline 0 C--N 1.317 -0.805 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.177 179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.741 ' HG3' ' HB3' ' A' ' 119' ' ' LYS . 4.9 Cg_endo -47.59 -31.05 13.31 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.551 2.834 . . . . 0.0 113.553 -178.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.7 pttt -74.05 -41.5 61.66 Favored 'General case' 0 CA--C 1.529 0.163 0 O-C-N 122.188 -0.32 . . . . 0.0 110.763 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HB3' HD13 ' A' ' 25' ' ' LEU . 1.5 m-20 -62.48 -37.44 85.98 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.233 175.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.13 -46.85 60.77 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.693 -1.14 . . . . 0.0 110.945 -179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.649 ' HA ' HD12 ' A' ' 34' ' ' LEU . 88.0 t80 -66.67 -31.46 72.14 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.945 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -53.0 63.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.001 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.451 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.3 OUTLIER -71.03 -26.31 63.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.896 177.701 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.649 HD12 ' HA ' ' A' ' 31' ' ' TYR . 7.1 mt -60.14 -55.36 34.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.24 179.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.473 ' HA ' ' HE2' ' A' ' 60' ' ' LYS . 0.2 OUTLIER -73.49 -32.11 64.12 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.282 -176.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -77.33 -28.59 53.16 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.95 0.405 . . . . 0.0 111.077 -176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -125.85 100.7 30.51 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.736 -177.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_exo -66.19 0.65 3.07 Favored 'Trans proline' 0 CA--C 1.53 0.316 0 C-N-CA 123.028 2.485 . . . . 0.0 112.887 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.68 -24.77 20.36 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.249 0.547 . . . . 0.0 109.814 177.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.693 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 55.8 mt -89.11 107.24 17.72 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.26 179.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.561 HG23 ' HB2' ' A' ' 61' ' ' ASN . 0.3 OUTLIER -95.11 145.37 25.04 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.513 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 88' ' ' PHE . 5.8 tp -103.36 130.04 50.56 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 175.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 92.3 mt -113.83 120.47 63.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.676 176.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.806 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -102.16 132.35 48.12 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.437 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -113.84 99.5 8.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.136 -178.664 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.636 ' HD2' ' OE2' ' A' ' 50' ' ' GLU . 3.9 mmt180 -156.51 -177.2 6.42 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 107.718 -1.216 . . . . 0.0 107.718 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.639 ' HB3' ' HD2' ' A' ' 48' ' ' PRO . 63.3 m-20 -111.35 168.98 6.8 Favored Pre-proline 0 C--N 1.316 -0.863 0 N-CA-C 109.893 -0.41 . . . . 0.0 109.893 178.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.639 ' HD2' ' HB3' ' A' ' 47' ' ' ASP . 55.9 Cg_endo -77.84 -23.44 9.44 Favored 'Trans proline' 0 C--N 1.346 0.412 0 C-N-CA 121.863 1.709 . . . . 0.0 114.454 -168.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -69.69 -49.64 51.54 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.141 -174.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.636 ' OE2' ' HD2' ' A' ' 46' ' ' ARG . 11.5 pm0 -70.25 -33.53 71.75 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.576 177.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.627 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.9 OUTLIER -62.73 -37.33 86.15 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.117 178.123 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.43 -37.31 84.9 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.35 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.64 -50.56 10.47 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -172.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -100.3 -33.57 10.35 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.139 -174.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 125.17 176.47 14.56 Favored Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.799 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.627 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.2 OUTLIER -143.89 158.42 56.05 Favored Pre-proline 0 C--N 1.324 -0.519 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 179.601 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.407 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 15.6 Cg_endo -62.83 138.45 68.89 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 121.996 1.797 . . . . 0.0 112.589 -178.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.406 ' HB2' ' HG ' ' A' ' 128' ' ' LEU . 3.6 t70 -112.41 94.05 4.74 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.686 177.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.729 HG22 ' HB2' ' A' ' 62' ' ' TYR . 2.0 m -131.95 162.61 39.29 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.303 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.473 ' HE2' ' HA ' ' A' ' 35' ' ' GLN . 0.0 OUTLIER -55.17 -45.56 75.73 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.37 -0.832 . . . . 0.0 112.045 -176.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.561 ' HB2' HG23 ' A' ' 41' ' ' THR . 14.0 p30 -122.56 73.48 1.12 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.76 0.79 . . . . 0.0 111.027 -177.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.806 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.6 t80 -114.95 128.41 56.27 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.981 177.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HE2' HG21 ' A' ' 41' ' ' THR . 3.4 mtmt -120.46 121.44 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.807 0.337 . . . . 0.0 110.444 177.377 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 10.6 t-160 -90.14 116.17 27.94 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 176.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.838 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.1 OUTLIER -110.94 93.54 4.54 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.824 -0.35 . . . . 0.0 110.831 -175.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.36 119.81 40.59 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.32 0.581 . . . . 0.0 112.026 -176.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.559 ' NE ' ' HA ' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -155.81 -122.85 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 170.281 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -77.01 -46.05 10.95 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 118.448 -1.834 . . . . 0.0 109.76 168.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.517 ' HA ' ' HE3' ' A' ' 69' ' ' LYS . 0.0 OUTLIER -166.56 52.22 0.08 Allowed 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.366 -0.417 . . . . 0.0 111.135 171.774 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.789 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 76.68 -8.32 1.69 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 172.629 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.68 ' HB2' ' HD3' ' A' ' 72' ' ' PRO . 0.4 OUTLIER -49.32 -64.84 1.0 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -177.041 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.68 ' HD3' ' HB2' ' A' ' 71' ' ' GLU . 11.4 Cg_exo -73.86 -17.26 22.83 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 122.205 1.937 . . . . 0.0 113.219 -176.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.838 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.6 OUTLIER -91.52 -29.01 17.21 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 111.708 0.262 . . . . 0.0 111.708 -173.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.68 HD12 HD13 ' A' ' 79' ' ' LEU . 0.0 OUTLIER -62.42 -29.81 70.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.299 0.571 . . . . 0.0 111.411 -177.849 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.562 ' HB2' ' HB2' ' B' ' 8' ' ' ASP . . . -71.18 -32.75 69.27 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.697 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.82 -15.33 42.31 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.425 0.528 . . . . 0.0 112.425 -174.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -27.39 59.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.783 0.325 . . . . 0.0 111.326 -176.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 99.1 61.07 0.86 Allowed Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.483 -0.865 . . . . 0.0 111.601 -176.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.68 HD13 HD12 ' A' ' 74' ' ' LEU . 11.1 mt -114.54 146.08 41.18 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 120.744 0.307 . . . . 0.0 110.688 -178.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -136.71 150.23 69.43 Favored Pre-proline 0 C--N 1.323 -0.581 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.419 176.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.65 17.01 0.47 Allowed 'Trans proline' 0 CA--C 1.528 0.195 0 C-N-CA 123.008 2.472 . . . . 0.0 113.667 -175.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -108.73 -1.28 19.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.155 0.503 . . . . 0.0 109.765 174.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 9.5 mmtm -100.06 128.73 30.03 Favored Pre-proline 0 C--N 1.324 -0.529 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.047 -177.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.693 ' O ' ' HA ' ' A' ' 40' ' ' ILE . 4.7 Cg_exo -74.83 122.17 7.11 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.565 2.177 . . . . 0.0 110.103 173.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.441 HG23 HD12 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -127.32 149.48 32.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 120.988 0.423 . . . . 0.0 111.132 -174.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -122.34 137.88 54.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.82 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.246 175.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.539 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 6.4 m -105.81 134.1 48.31 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.947 ' HB2' HD11 ' A' ' 42' ' ' LEU . 24.9 t80 -118.23 144.15 45.99 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.424 -173.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 81.96 72.16 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.766 0.826 . . . . 0.0 110.747 -175.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.902 ' HA ' ' H ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -93.75 1.73 56.43 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.871 -177.244 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.501 ' HB ' ' H ' ' A' ' 92' ' ' ALA . 0.0 OUTLIER -77.23 -102.45 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -175.049 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.573 ' HA ' ' O ' ' B' ' 68' ' ' GLY . . . -68.52 -43.5 76.62 Favored 'General case' 0 C--O 1.233 0.186 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -174.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.488 ' HB2' ' HD3' ' A' ' 46' ' ' ARG . . . -73.13 -27.17 61.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.581 -179.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.404 ' HG3' ' HG2' ' B' ' 69' ' ' LYS . 0.1 OUTLIER 68.5 78.86 0.22 Allowed 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.963 177.261 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.902 ' H ' ' HA ' ' A' ' 90' ' ' LYS . . . -64.75 -8.97 16.95 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.55 173.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.26 -36.72 76.02 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.556 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.439 HD13 ' HA ' ' A' ' 97' ' ' LEU . 3.4 mm? -70.44 -30.05 66.79 Favored 'General case' 0 C--O 1.221 -0.404 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.363 176.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -75.83 -41.45 52.52 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.739 -177.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -93.63 -44.17 3.74 Favored Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.665 -171.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.41 ' HB3' ' CE ' ' A' ' 22' ' ' MET . 0.0 OUTLIER -65.26 -23.72 67.12 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.642 -0.328 . . . . 0.0 111.516 -174.858 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.67 -54.24 14.81 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-O 121.131 0.491 . . . . 0.0 111.252 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.624 ' HB2' HD13 ' A' ' 110' ' ' ILE . 57.0 mt -56.27 -38.17 70.8 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 114.967 -1.015 . . . . 0.0 112.198 -172.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.435 ' HG2' HG21 ' A' ' 110' ' ' ILE . 0.3 OUTLIER -68.05 -31.21 70.7 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.121 -179.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -77.86 -8.65 58.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.851 0.357 . . . . 0.0 110.938 176.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.594 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 16.7 m-30 -92.77 -38.28 11.88 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 174.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 135.09 50.94 0.07 OUTLIER Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.476 -0.868 . . . . 0.0 112.583 174.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.426 ' CE1' HD22 ' A' ' 102' ' ' LEU . 2.2 m-85 -92.92 159.73 15.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.617 0.246 . . . . 0.0 110.623 179.211 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.66 -69.02 0.39 Allowed 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.466 -177.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -138.05 117.4 12.78 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.981 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.624 HD13 ' HB2' ' A' ' 102' ' ' LEU . 1.0 OUTLIER -119.16 128.84 75.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 CA-C-O 121.217 0.532 . . . . 0.0 110.948 -179.578 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -119.27 152.28 36.96 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.544 -178.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -121.98 148.48 44.74 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.459 ' O ' ' HG2' ' A' ' 90' ' ' LYS . 5.8 m -89.11 113.47 24.63 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -174.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.649 ' HG2' ' HB3' ' A' ' 24' ' ' MET . 1.0 OUTLIER -64.45 143.45 57.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.623 177.646 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 96.0 -104.93 3.17 Favored Glycine 0 N--CA 1.443 -0.854 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 171.11 -165.07 38.19 Favored Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' MET . . . . . 0.577 ' HA ' ' CZ ' ' A' ' 88' ' ' PHE . 9.5 tpt -65.41 -29.48 70.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.228 0.537 . . . . 0.0 110.036 178.038 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.6 OUTLIER -61.71 -28.77 69.66 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.472 -0.786 . . . . 0.0 111.002 178.457 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.741 ' HB3' ' HG3' ' A' ' 27' ' ' PRO . 0.0 OUTLIER -73.56 -33.01 64.46 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 111.447 0.165 . . . . 0.0 111.447 -178.929 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.854 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 18.8 t-105 -61.33 -54.54 42.59 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 120.828 0.347 . . . . 0.0 110.069 178.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.463 HD23 ' HA ' ' A' ' 121' ' ' LEU . 7.2 mt -62.89 -41.88 99.58 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.892 178.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.587 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 0.5 OUTLIER -65.33 -40.52 93.8 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.145 -0.48 . . . . 0.0 112.159 -177.007 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.601 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 2.7 tp10 -73.18 -4.89 35.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.918 0.39 . . . . 0.0 111.159 -177.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 75.49 27.33 63.63 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.935 -0.65 . . . . 0.0 111.771 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.601 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 97.1 mt -79.76 157.67 74.02 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 110.335 -0.246 . . . . 0.0 110.335 -178.646 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.405 ' HB2' ' O ' ' A' ' 58' ' ' ASP . 20.6 Cg_endo -57.09 120.36 8.23 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 123.299 2.666 . . . . 0.0 112.209 -179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -130.47 151.77 50.6 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.483 -179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.406 ' HG ' ' HB2' ' A' ' 58' ' ' ASP . 0.8 OUTLIER -100.52 107.87 19.67 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 176.506 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.06 139.81 27.65 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.385 -175.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 2.0 ttt-85 -83.82 87.69 7.09 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.958 178.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 m -40.33 113.77 0.39 Allowed 'General case' 0 C--O 1.235 0.299 0 O-C-N 124.03 0.831 . . . . 0.0 112.475 -176.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 25.5 m170 -79.69 83.77 5.61 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.589 -177.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 1.6 m-70 -110.41 -12.66 14.38 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.83 0.348 . . . . 0.0 111.151 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -99.89 2.74 44.07 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.233 0.54 . . . . 0.0 110.081 177.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -84.24 63.11 7.54 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.527 176.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.25 -0.98 43.16 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.084 -177.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.252 1.191 0 CA-C-O 117.705 -1.14 . . . . 0.0 109.095 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 121.089 0.471 . . . . 0.0 110.032 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -167.62 33.59 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.458 -175.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.75 0.05 40.85 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.107 -178.153 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.76 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.67 -32.86 70.31 Favored Glycine 0 C--O 1.223 -0.541 0 CA-C-N 116.055 -0.52 . . . . 0.0 112.195 178.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -74.12 -31.61 62.84 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.059 0.457 . . . . 0.0 110.599 175.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 25.6 mmtt -69.35 -57.19 5.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.887 -0.597 . . . . 0.0 112.076 -175.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.76 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 3.8 p90 -72.56 -26.64 61.81 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.039 -0.664 . . . . 0.0 111.089 -177.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . 0.562 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 0.3 OUTLIER -53.59 -42.78 67.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.556 -179.479 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.52 -40.61 92.07 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.995 177.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.82 -45.06 83.67 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.706 177.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' PHE . . . . . 0.594 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 0.1 OUTLIER -55.9 -46.94 78.23 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 121.307 0.575 . . . . 0.0 110.345 177.168 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' LYS . . . . . 0.642 ' O ' ' HB2' ' B' ' 16' ' ' LYS . 0.0 OUTLIER -64.24 -27.5 69.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.397 178.757 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.94 -42.03 58.48 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.177 179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -70.96 -50.61 32.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.465 -179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.477 HG21 ' HG2' ' A' ' 71' ' ' GLU . 0.9 OUTLIER -63.46 -33.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.949 -178.442 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.642 ' HB2' ' O ' ' B' ' 12' ' ' LYS . 0.0 OUTLIER -59.9 -39.36 85.09 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.573 0.225 . . . . 0.0 111.551 178.412 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.78 -26.39 68.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.977 0.418 . . . . 0.0 111.205 -179.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.52 -31.54 65.42 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.492 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 -24.94 42.41 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.164 0.507 . . . . 0.0 111.128 173.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.61 -15.75 41.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.65 -0.705 . . . . 0.0 112.166 -173.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -70.98 -23.27 62.17 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 -171.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.409 ' SD ' ' HB2' ' B' ' 112' ' ' ASN . 1.5 ptp -139.7 172.87 12.16 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.811 -177.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 22.9 t -67.27 109.55 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.553 -177.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -83.43 121.16 26.8 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.251 178.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.484 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.5 mt -129.5 141.63 50.95 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.9 -177.814 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.52 145.7 82.65 Favored Pre-proline 0 C--N 1.315 -0.934 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 177.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.552 ' HG3' ' HB3' ' B' ' 119' ' ' LYS . 1.3 Cg_endo -45.22 -29.74 4.57 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 124.01 3.14 . . . . 0.0 114.415 -175.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.47 -44.84 49.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.838 0.352 . . . . 0.0 111.143 177.048 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.13 -29.9 68.91 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.472 178.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.412 ' HB1' HG21 ' B' ' 86' ' ' VAL . . . -74.35 -42.31 59.6 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.651 177.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' TYR . . . . . 0.507 ' CZ ' ' HG3' ' B' ' 126' ' ' PRO . 38.8 t80 -64.25 -40.59 96.33 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.036 0.446 . . . . 0.0 110.806 178.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . 0.437 ' O ' ' HB2' ' B' ' 36' ' ' GLU . 0.1 OUTLIER -50.3 -53.76 26.26 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.945 -1.025 . . . . 0.0 111.262 -177.421 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.597 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.3 OUTLIER -74.94 -27.57 60.24 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.456 -0.338 . . . . 0.0 111.268 178.375 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.572 HD11 ' HB2' ' B' ' 42' ' ' LEU . 3.2 mt -63.85 -57.52 9.61 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.146 0.498 . . . . 0.0 112.027 -178.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -78.28 -18.28 55.49 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.047 -172.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.437 ' HB2' ' O ' ' B' ' 32' ' ' LYS . 0.4 OUTLIER -98.2 -9.09 26.21 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.588 -176.537 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -133.76 106.74 11.72 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.818 0.342 . . . . 0.0 110.298 177.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . 0.446 ' HA ' HD21 ' B' ' 61' ' ' ASN . 27.6 Cg_exo -65.5 -2.73 6.57 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 123.23 2.62 . . . . 0.0 113.696 -176.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.54 -25.91 18.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.004 0.431 . . . . 0.0 110.115 178.039 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.597 HD12 ' HB2' ' B' ' 33' ' ' LEU . 9.1 mt -82.62 108.09 15.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.412 178.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.664 HG21 ' HE2' ' B' ' 63' ' ' LYS . 0.2 OUTLIER -101.57 144.83 29.84 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.093 -177.681 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.93 HD11 ' HB2' ' B' ' 88' ' ' PHE . 0.9 OUTLIER -103.96 127.96 51.5 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 176.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 2.0 mp -108.82 119.58 58.65 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 175.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.875 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -110.08 136.12 49.81 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.701 -178.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.489 ' O ' ' HB1' ' B' ' 93' ' ' ALA . 0.0 OUTLIER -124.09 100.05 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-N 114.916 -1.038 . . . . 0.0 108.88 178.359 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 9.3 tpt180 -153.88 152.93 31.2 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.287 -0.415 . . . . 0.0 109.964 -174.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -69.68 135.13 88.11 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.771 0.319 . . . . 0.0 110.566 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -63.01 -19.22 68.6 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.084 2.523 . . . . 0.0 113.851 -175.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -78.32 -40.08 37.75 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.825 -178.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -67.57 -35.21 78.58 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 173.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.833 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.7 OUTLIER -60.27 -34.76 74.17 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.66 174.296 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 17.8 mtmm -71.97 -41.74 67.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.834 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.99 -47.77 14.41 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.855 -0.611 . . . . 0.0 112.151 -172.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 12.4 mtt -102.36 -34.31 9.23 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.607 -173.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.94 178.28 15.45 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.821 176.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' LYS . . . . . 0.833 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 6.6 pttt -135.18 155.3 79.01 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 178.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -56.86 127.44 25.84 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.543 2.162 . . . . 0.0 112.892 -178.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . 0.671 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 26.5 t0 -101.99 81.68 2.14 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.272 179.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.788 HG22 ' HB2' ' B' ' 62' ' ' TYR . 0.9 OUTLIER -120.13 157.48 22.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.194 -179.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.65 -51.96 63.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.643 -175.136 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.452 ' HB2' ' HA ' ' B' ' 41' ' ' THR . 0.2 OUTLIER -109.82 80.65 1.33 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.983 0.42 . . . . 0.0 110.545 -179.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.875 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.5 t80 -121.32 130.56 53.71 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.046 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.664 ' HE2' HG21 ' B' ' 41' ' ' THR . 3.9 mttm -129.59 121.86 27.96 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.364 177.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 5.0 t-160 -84.92 111.18 19.44 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' MET . . . . . 0.624 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.5 OUTLIER -109.34 98.05 7.53 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.729 0.299 . . . . 0.0 110.289 -177.719 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 2.6 m -117.85 120.67 38.59 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.186 0.517 . . . . 0.0 112.25 -173.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' ARG . . . . . 0.429 HH11 ' HD3' ' B' ' 67' ' ' ARG . 0.0 OUTLIER -149.79 -131.46 0.05 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 172.247 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . 0.573 ' O ' ' HA ' ' A' ' 92' ' ' ALA . . . -86.97 -45.03 5.52 Favored Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 118.999 -1.572 . . . . 0.0 109.752 169.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' LYS . . . . . 0.461 ' HA ' ' HD3' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -143.99 43.3 1.45 Allowed 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 170.234 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.59 HD11 HD13 ' B' ' 74' ' ' LEU . 0.0 OUTLIER 60.64 -7.3 0.08 Allowed 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.523 1.305 . . . . 0.0 114.523 173.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.611 ' CD ' ' HD3' ' B' ' 72' ' ' PRO . 0.3 OUTLIER -44.82 -58.23 5.74 Favored Pre-proline 0 CA--C 1.545 0.767 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -172.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.611 ' HD3' ' CD ' ' B' ' 71' ' ' GLU . 6.8 Cg_exo -73.52 -16.13 24.38 Favored 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.507 2.138 . . . . 0.0 112.818 -179.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.624 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.2 OUTLIER -87.87 -19.68 27.06 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.458 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.651 HD21 HD21 ' B' ' 102' ' ' LEU . 24.2 tp -60.6 -51.42 69.47 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.701 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.602 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -63.85 -24.0 67.57 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.0 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -77.76 -22.05 50.82 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.794 -177.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' SER . . . . . 0.574 ' HB2' ' HG ' ' B' ' 79' ' ' LEU . 0.3 OUTLIER -75.17 -39.65 60.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.803 0.335 . . . . 0.0 110.556 -179.801 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.71 39.32 6.26 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.925 -177.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.574 ' HG ' ' HB2' ' B' ' 77' ' ' SER . 7.3 mt -83.2 151.75 25.53 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.602 0.239 . . . . 0.0 110.558 179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.475 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.6 OUTLIER -125.48 133.72 25.13 Favored Pre-proline 0 C--N 1.321 -0.646 0 N-CA-C 109.997 -0.371 . . . . 0.0 109.997 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 37.4 Cg_exo -64.84 4.38 0.67 Allowed 'Trans proline' 0 CA--C 1.529 0.244 0 C-N-CA 123.502 2.801 . . . . 0.0 113.822 -176.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.37 -2.02 24.38 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.836 0.35 . . . . 0.0 110.799 177.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 3.1 mttm -109.74 146.03 33.21 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 116.295 -0.411 . . . . 0.0 109.94 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.576 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 7.9 Cg_exo -75.08 143.57 28.96 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.618 2.212 . . . . 0.0 111.832 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.4 OUTLIER -143.74 147.43 19.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.759 -178.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.412 HG21 ' HB1' ' B' ' 30' ' ' ALA . 2.3 p -124.78 139.63 50.38 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.691 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.572 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 4.4 m -109.28 124.31 65.86 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.094 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.93 ' HB2' HD11 ' B' ' 42' ' ' LEU . 9.6 t80 -104.4 136.62 43.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.148 -171.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . 0.426 ' HB3' ' HB3' ' B' ' 93' ' ' ALA . 0.1 OUTLIER 87.68 66.85 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.67 0 O-C-N 124.291 0.995 . . . . 0.0 111.661 -179.321 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.539 ' HG2' ' O ' ' B' ' 113' ' ' SER . 0.0 OUTLIER -75.08 -21.48 58.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.54 178.75 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' THR . . . . . 0.41 ' HB ' ' H ' ' B' ' 92' ' ' ALA . 0.1 OUTLIER -73.47 -107.85 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.984 -173.302 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.41 ' H ' ' HB ' ' B' ' 91' ' ' THR . . . -55.24 -41.6 72.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.111 0.482 . . . . 0.0 112.198 -175.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.489 ' HB1' ' O ' ' B' ' 45' ' ' VAL . . . -74.67 -27.93 60.63 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.09 -0.505 . . . . 0.0 112.018 -177.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' B' ' 94' ' ' ARG . 5.7 mmp_? 64.1 55.9 1.46 Allowed 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.258 -179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.572 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -62.85 -14.38 45.27 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.179 177.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' ALA . . . . . 0.587 ' HA ' HD21 ' B' ' 112' ' ' ASN . . . -54.77 -29.5 54.21 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.276 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' B' ' 97' ' ' LEU . 1.9 mm? -70.28 -32.04 69.67 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.888 0.375 . . . . 0.0 111.054 177.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.03 -44.26 55.0 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.01 0.433 . . . . 0.0 110.838 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -80.45 -48.3 6.4 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.629 -0.796 . . . . 0.0 113.444 -175.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 100' ' ' LYS . . . . . 0.434 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -59.62 -42.74 93.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.809 0.337 . . . . 0.0 111.56 -172.748 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . 0.434 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 0.7 OUTLIER -69.71 -35.34 74.97 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.461 -178.094 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.651 HD21 HD21 ' B' ' 74' ' ' LEU . 9.2 mt -62.56 -50.42 71.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.554 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.575 ' HB3' HG21 ' B' ' 110' ' ' ILE . 0.9 OUTLIER -65.98 -30.69 71.29 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.887 0.375 . . . . 0.0 110.597 -179.891 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . 0.426 ' N ' ' HG3' ' B' ' 103' ' ' ARG . 7.2 mt-10 -71.24 -7.07 44.39 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.335 176.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 18.9 m-30 -108.46 -11.51 15.15 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.666 -0.243 . . . . 0.0 110.746 177.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 129.74 14.73 2.05 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.017 -1.087 . . . . 0.0 113.89 171.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' PHE . . . . . 0.57 ' CE1' HD22 ' B' ' 102' ' ' LEU . 4.9 m-85 -70.97 140.23 50.82 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.399 0.599 . . . . 0.0 110.595 179.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.43 -81.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.784 -172.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.501 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -111.47 103.04 11.36 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.817 -176.213 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' ILE . . . . . 0.575 HG21 ' HB3' ' B' ' 103' ' ' ARG . 1.3 tt -114.47 131.1 67.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 CA-C-O 121.472 0.653 . . . . 0.0 110.889 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -120.28 151.5 39.11 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.295 -178.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.587 HD21 ' HA ' ' B' ' 96' ' ' ALA . 4.6 t-20 -123.1 148.86 45.2 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.594 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 4.8 m -83.54 138.4 33.42 Favored 'General case' 0 C--N 1.313 -1.002 0 C-N-CA 120.629 -0.428 . . . . 0.0 111.443 -177.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -97.39 152.99 18.38 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.117 170.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.98 -87.93 1.32 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.793 -176.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . 0.525 ' HA3' ' S5 ' ' B' ' 139' ' ' PS5 . . . 150.31 -166.81 30.13 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.033 178.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 117' ' ' MET . . . . . 0.504 ' HA ' ' CZ ' ' B' ' 88' ' ' PHE . 7.7 tmm? -67.96 -33.01 73.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.991 0.424 . . . . 0.0 110.66 179.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.569 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 0.0 OUTLIER -63.87 -29.63 70.8 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.634 178.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 119' ' ' LYS . . . . . 0.552 ' HB3' ' HG3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -69.14 -33.56 73.63 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.868 -0.151 . . . . 0.0 111.368 177.872 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.847 ' HB2' ' HZ ' ' B' ' 88' ' ' PHE . 34.8 t-105 -60.86 -53.56 55.79 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 178.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' B' ' 121' ' ' LEU . 9.5 mt -64.94 -39.73 93.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.012 178.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.569 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.3 OUTLIER -63.94 -34.62 78.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.716 -176.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . 0.553 ' HB3' ' HG ' ' B' ' 125' ' ' LEU . 0.7 OUTLIER -82.49 -0.85 48.35 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.939 0.399 . . . . 0.0 111.095 -178.576 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 71.26 29.38 68.55 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.849 -0.691 . . . . 0.0 112.143 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.553 ' HG ' ' HB3' ' B' ' 123' ' ' GLU . 77.6 mt -79.68 160.77 68.8 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 110.264 -0.273 . . . . 0.0 110.264 -178.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.604 ' HB2' ' HB3' ' B' ' 58' ' ' ASP . 21.9 Cg_endo -57.42 121.9 10.84 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 123.042 2.495 . . . . 0.0 112.152 -179.415 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.56 151.14 52.02 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.436 -178.158 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 128' ' ' LEU . . . . . 0.671 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.1 mt -109.7 101.37 10.28 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 176.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -131.05 144.91 51.8 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -177.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 130' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' B' ' 130' ' ' ARG . 0.3 OUTLIER -88.48 82.16 7.01 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.482 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.1 m -42.41 116.22 0.81 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.962 -173.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 132' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' B' ' 135' ' ' HIS . 66.8 m80 -81.04 64.75 5.91 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.859 -175.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -75.39 -12.41 60.25 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.979 0.419 . . . . 0.0 110.799 179.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 16.6 t-80 -79.92 -4.54 52.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.071 175.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 135' ' ' HIS . . . . . 0.469 ' HB2' ' O ' ' B' ' 132' ' ' HIS . 0.1 OUTLIER -81.48 62.69 5.47 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.184 0.516 . . . . 0.0 110.667 179.236 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -73.06 -18.16 61.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.06 178.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 15.4 t-160 . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.211 -0.9 . . . . 0.0 109.501 177.224 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' PS5 . . . . . 0.451 ' S3 ' ' HB3' ' A' ' 117' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 139' ' ' PS5 . . . . . 0.551 ' S5 ' ' HB3' ' B' ' 118' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.421 ' HA ' ' OD1' ' B' ' 80' ' ' ASP . . . . . . . . 0 N--CA 1.479 1.001 0 CA-C-O 121.032 0.444 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -138.14 -5.06 1.67 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.052 -178.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.428 ' HG3' ' HB2' ' A' ' 6' ' ' LYS . 2.8 tpp -80.39 8.34 7.79 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.576 -178.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.588 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -55.99 -32.03 59.14 Favored Glycine 0 C--O 1.229 -0.192 0 CA-C-N 116.205 -0.452 . . . . 0.0 112.943 179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -76.19 -33.08 59.29 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.75 0.31 . . . . 0.0 111.095 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.428 ' HB2' ' HG3' ' A' ' 3' ' ' MET . 20.1 mmtt -68.9 -58.04 4.69 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -172.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.588 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.6 OUTLIER -72.29 -34.05 67.89 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.745 -0.782 . . . . 0.0 111.468 -173.496 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.72 -57.35 11.17 Favored 'General case' 0 N--CA 1.468 0.437 0 O-C-N 123.309 0.381 . . . . 0.0 110.931 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.49 -45.58 91.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.66 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.3 m -67.15 -44.94 78.53 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.786 -0.188 . . . . 0.0 111.255 -179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.418 ' HB2' ' O ' ' A' ' 7' ' ' PHE . 0.3 OUTLIER -54.16 -42.96 70.2 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.32 0.581 . . . . 0.0 109.908 178.485 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.539 ' O ' ' HB2' ' A' ' 16' ' ' LYS . 0.7 OUTLIER -65.94 -26.24 67.49 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.904 177.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.85 -45.66 49.76 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.852 0.358 . . . . 0.0 110.914 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -71.77 -50.47 29.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.96 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.746 HG11 ' HG2' ' B' ' 71' ' ' GLU . 0.8 OUTLIER -68.38 -34.19 64.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.445 0 CA-C-N 115.801 -0.636 . . . . 0.0 112.464 -172.628 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.539 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 0.0 OUTLIER -66.53 -27.74 68.0 Favored 'General case' 0 C--O 1.233 0.219 0 O-C-N 122.222 -0.299 . . . . 0.0 111.157 -177.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.48 -25.73 66.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.005 0.431 . . . . 0.0 111.187 178.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.24 70.19 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.999 -0.546 . . . . 0.0 112.023 -179.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.78 -23.94 49.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.313 0.578 . . . . 0.0 110.93 175.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -86.77 -20.68 27.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.421 -0.809 . . . . 0.0 111.977 -176.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.03 -32.86 73.4 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 -173.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.46 ' HG3' ' HB2' ' A' ' 112' ' ' ASN . 6.6 ptm -125.7 178.73 5.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.98 0.419 . . . . 0.0 111.924 -175.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 60.0 t -74.58 111.44 10.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.098 -178.493 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.675 ' HE2' ' HB3' ' A' ' 112' ' ' ASN . 2.0 mmt -79.89 105.41 11.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.861 -178.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.442 ' HB2' ' HB3' ' A' ' 111' ' ' TYR . 0.4 OUTLIER -113.11 139.63 48.56 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.096 0.474 . . . . 0.0 110.583 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.7 143.29 67.13 Favored Pre-proline 0 C--N 1.32 -0.704 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.796 178.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -51.29 -24.33 15.4 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.632 2.888 . . . . 0.0 113.951 -176.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.1 mtmt -74.29 -43.87 55.04 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.071 0.462 . . . . 0.0 110.909 177.117 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -73.45 -29.13 62.35 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.566 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.61 -45.34 62.42 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.634 178.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.558 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 74.5 t80 -67.23 -32.02 72.78 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 121.033 -0.267 . . . . 0.0 110.997 179.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 8.8 tptt -56.29 -50.17 72.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.146 -179.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.51 ' O ' ' HB2' ' A' ' 37' ' ' ASN . 0.3 OUTLIER -74.23 -27.53 60.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.565 -0.289 . . . . 0.0 110.678 177.648 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.641 HD11 ' HB2' ' A' ' 42' ' ' LEU . 2.5 mt -64.23 -48.27 76.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.027 0.441 . . . . 0.0 111.379 179.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -75.55 -21.93 57.48 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.416 -175.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.98 -27.89 15.42 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.95 0.405 . . . . 0.0 111.232 -177.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 33' ' ' LEU . 5.9 m-80 -112.24 108.91 54.58 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.515 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -71.39 0.57 6.61 Favored 'Trans proline' 0 CA--C 1.532 0.396 0 C-N-CA 122.779 2.319 . . . . 0.0 112.037 177.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -102.72 -26.44 13.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.586 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.837 HG12 ' HG2' ' A' ' 84' ' ' PRO . 36.7 mt -80.66 113.42 20.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.73 175.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.79 144.06 31.98 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.966 -177.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.997 HD11 ' HB2' ' A' ' 88' ' ' PHE . 27.2 tp -96.56 121.41 38.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.444 ' O ' ' HA ' ' A' ' 87' ' ' VAL . 88.2 mt -103.18 111.11 31.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.777 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -104.73 140.85 37.47 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.108 -176.855 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . 0.408 HG21 ' HA ' ' A' ' 95' ' ' ALA . 0.0 OUTLIER -124.18 98.22 5.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.489 177.549 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.552 ' HD2' ' H ' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -144.19 149.17 35.99 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.404 179.249 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.552 ' H ' ' HD2' ' A' ' 46' ' ' ARG . 4.5 m-20 -67.67 141.17 94.88 Favored Pre-proline 0 C--N 1.316 -0.891 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.039 -175.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_endo -58.13 -25.75 72.73 Favored 'Trans proline' 0 C--N 1.343 0.269 0 C-N-CA 123.546 2.831 . . . . 0.0 114.464 -169.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.21 -43.48 57.01 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 119.974 -0.69 . . . . 0.0 111.955 -176.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 46' ' ' ARG . 27.2 tt0 -65.1 -35.37 80.9 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.48 -0.488 . . . . 0.0 109.857 176.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.659 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 0.4 OUTLIER -57.38 -35.42 69.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.72 176.353 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 24.5 mtpt -79.61 -43.54 22.72 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.253 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -91.12 -48.07 7.17 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.8 mtm -95.56 -35.1 11.78 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.649 -0.42 . . . . 0.0 111.339 -174.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.69 171.03 12.9 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.468 -0.873 . . . . 0.0 113.641 174.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.659 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -142.49 162.35 45.12 Favored Pre-proline 0 C--N 1.327 -0.382 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 178.658 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -62.83 132.44 37.3 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 121.934 1.756 . . . . 0.0 112.679 -176.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.413 ' O ' ' HB2' ' A' ' 126' ' ' PRO . 20.0 t0 -107.37 77.41 1.14 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.068 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.448 HG22 ' HB2' ' A' ' 62' ' ' TYR . 3.0 m -119.3 166.78 13.35 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.21 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -65.6 -41.16 93.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.982 -175.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.25 86.0 2.51 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.033 0.444 . . . . 0.0 111.036 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.777 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 1.0 OUTLIER -128.98 132.81 47.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.56 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.95 119.78 32.5 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.473 177.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -86.68 118.73 26.28 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 175.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.738 ' HB3' ' HB2' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -113.26 91.8 3.78 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.293 -0.563 . . . . 0.0 111.264 -174.713 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.54 139.31 36.39 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.056 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.862 ' HG2' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -176.97 -143.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.437 -1.319 . . . . 0.0 107.437 177.841 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -79.59 -42.78 10.99 Favored Glycine 0 N--CA 1.444 -0.809 0 C-N-CA 118.852 -1.642 . . . . 0.0 109.386 168.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.737 ' HE2' ' HG3' ' B' ' 94' ' ' ARG . 0.0 OUTLIER -155.45 47.34 0.51 Allowed 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 114.558 -0.821 . . . . 0.0 110.075 171.418 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.738 ' HB2' ' HB3' ' A' ' 65' ' ' MET . 0.0 OUTLIER 64.99 -6.51 0.33 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 113.905 1.076 . . . . 0.0 113.905 174.33 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.795 ' HG2' HG11 ' B' ' 15' ' ' VAL . 0.2 OUTLIER -44.05 -61.82 1.82 Allowed Pre-proline 0 CA--C 1.546 0.822 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -172.952 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.862 ' HD2' ' HG2' ' A' ' 67' ' ' ARG . 7.6 Cg_exo -73.86 -15.85 23.59 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.448 2.098 . . . . 0.0 113.146 -178.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.6 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.1 OUTLIER -90.01 -19.08 24.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.908 0.385 . . . . 0.0 110.874 -177.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.495 ' CD1' HD21 ' A' ' 102' ' ' LEU . 0.0 OUTLIER -73.14 -28.94 62.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.385 0.612 . . . . 0.0 110.43 -179.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -77.56 -28.28 51.77 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.958 173.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.98 -18.06 59.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.399 -0.819 . . . . 0.0 111.943 -177.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -79.69 -41.3 27.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.969 0.414 . . . . 0.0 110.281 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.85 55.34 1.15 Allowed Glycine 0 N--CA 1.446 -0.66 0 C-N-CA 120.628 -0.796 . . . . 0.0 111.395 -177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 10.9 mt -94.32 145.22 24.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.665 0.269 . . . . 0.0 110.493 -178.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -127.1 158.1 70.08 Favored Pre-proline 0 C--N 1.324 -0.513 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.546 ' HD3' ' HB2' ' B' ' 3' ' ' MET . 45.5 Cg_endo -70.93 9.16 0.84 Allowed 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 122.89 2.393 . . . . 0.0 114.158 -174.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.406 ' H ' ' HG3' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -118.06 -1.9 11.34 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.824 0.345 . . . . 0.0 110.585 179.062 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 84' ' ' PRO . 7.3 mmtm -88.53 134.6 33.89 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.29 -176.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.837 ' HG2' HG12 ' A' ' 40' ' ' ILE . 27.9 Cg_endo -88.29 124.31 1.7 Allowed 'Trans proline' 0 N--CA 1.45 -1.051 0 C-N-CA 123.05 2.5 . . . . 0.0 111.261 175.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.508 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -135.35 149.92 28.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 120.959 0.409 . . . . 0.0 111.205 -176.079 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 1.5 p -124.29 141.2 45.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.768 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 176.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.916 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 8.0 m -106.91 133.53 51.25 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.997 ' HB2' HD11 ' A' ' 42' ' ' LEU . 14.4 t80 -116.97 137.2 52.38 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.935 -171.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 117' ' ' MET . 0.1 OUTLIER 84.24 101.43 0.04 OUTLIER 'General case' 0 N--CA 1.472 0.672 0 O-C-N 124.407 1.067 . . . . 0.0 112.034 178.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.741 ' HA ' ' HA ' ' A' ' 94' ' ' ARG . 0.0 OUTLIER -124.09 11.49 8.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.027 178.138 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.84 17.78 17.32 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -174.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -165.83 -72.1 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.089 0.471 . . . . 0.0 110.405 177.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -70.85 -27.44 63.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.313 177.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.762 ' HG3' ' HG2' ' B' ' 69' ' ' LYS . 1.3 mmt85 67.97 90.88 0.09 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.685 177.876 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.916 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . -66.03 -9.06 27.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.242 177.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.453 ' HA ' ' ND2' ' A' ' 112' ' ' ASN . . . -58.64 -34.94 71.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.194 179.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -67.11 -30.41 70.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.55 -0.295 . . . . 0.0 110.866 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -76.52 -40.6 49.54 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.791 -176.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -96.86 -40.8 3.72 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.852 -171.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 -25.02 67.75 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.847 0.356 . . . . 0.0 111.24 -174.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.59 -49.67 38.19 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.842 177.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.495 HD21 ' CD1' ' A' ' 74' ' ' LEU . 22.8 mt -57.79 -42.21 83.69 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.682 -174.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.412 ' HD3' ' HB3' ' A' ' 22' ' ' MET . 0.0 OUTLIER -68.68 -26.62 65.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.84 0.352 . . . . 0.0 110.742 178.314 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -76.71 -8.39 57.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.226 177.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.477 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 14.2 m-85 -105.26 -42.05 5.37 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 176.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 142.53 85.32 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.509 -0.853 . . . . 0.0 112.349 177.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.453 ' CE1' HD22 ' A' ' 102' ' ' LEU . 1.5 m-85 -126.44 156.75 40.14 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.605 0.24 . . . . 0.0 110.601 178.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.79 -71.29 0.24 Allowed 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.354 -176.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.45 111.94 9.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.05 -177.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.508 ' HA ' ' O ' ' A' ' 85' ' ' VAL . 1.5 tt -122.92 128.94 75.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-O 121.304 0.573 . . . . 0.0 111.062 -178.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.442 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 0.9 OUTLIER -117.52 149.84 39.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.501 -177.206 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.675 ' HB3' ' HE2' ' A' ' 24' ' ' MET . 8.1 t-20 -118.63 144.77 45.93 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 175.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.454 ' CB ' ' HD1' ' A' ' 88' ' ' PHE . 92.0 p -81.56 135.57 35.58 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.137 0.494 . . . . 0.0 111.95 -171.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -85.49 136.74 33.3 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.156 -0.929 . . . . 0.0 108.617 169.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 87.07 -127.13 8.28 Favored Glycine 0 N--CA 1.438 -1.2 0 C-N-CA 120.479 -0.867 . . . . 0.0 111.271 -172.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . -178.75 -159.96 23.98 Favored Glycine 0 N--CA 1.448 -0.547 0 N-CA-C 111.564 -0.614 . . . . 0.0 111.564 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' MET . . . . . 0.464 ' HB2' ' SG ' ' A' ' 89' ' ' CYS . 0.0 OUTLIER -58.78 -33.79 70.71 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.941 0.401 . . . . 0.0 110.712 178.663 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.478 ' O ' ' HB2' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -59.25 -34.37 72.14 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.962 178.465 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.451 ' HD2' ' OD1' ' A' ' 118' ' ' ASP . 0.0 OUTLIER -73.93 -32.14 63.38 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 120.488 0.185 . . . . 0.0 111.174 -179.385 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.749 ' HB2' ' HZ ' ' A' ' 88' ' ' PHE . 18.6 t-105 -62.39 -54.28 42.58 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 178.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.474 ' HA ' HD23 ' A' ' 121' ' ' LEU . 2.2 mt -63.77 -42.4 97.78 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.7 0.286 . . . . 0.0 111.045 178.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 118' ' ' ASP . 2.1 tt0 -62.1 -40.98 97.69 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.793 -177.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.545 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.8 OUTLIER -77.78 -0.72 28.18 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.91 -178.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 69.12 29.67 72.14 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.93 -0.653 . . . . 0.0 111.925 178.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.545 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 75.2 mt -77.4 158.42 79.15 Favored Pre-proline 0 N--CA 1.45 -0.472 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.545 ' HG3' ' CZ ' ' A' ' 31' ' ' TYR . 19.7 Cg_endo -55.31 114.41 1.86 Allowed 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 123.262 2.642 . . . . 0.0 112.129 -179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -135.78 152.9 51.57 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.073 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.0 mt -102.96 100.5 10.46 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 175.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -133.32 143.44 49.01 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.775 -178.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.37 114.73 27.22 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.55 -176.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.36 100.05 0.6 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.828 -179.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 22.4 m80 -79.48 66.87 5.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.516 178.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -86.41 1.04 52.73 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.435 -173.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -95.08 47.36 1.14 Allowed 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.124 0.488 . . . . 0.0 110.173 177.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 10.6 m-70 -120.42 41.89 3.12 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.471 -178.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.5 -26.08 62.53 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.166 0.507 . . . . 0.0 109.661 177.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 2.7 t60 . . . . . 0 C--O 1.253 1.251 0 CA-C-O 117.784 -1.103 . . . . 0.0 108.515 177.533 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.004 0 CA-C-O 120.822 0.344 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -150.29 129.39 12.69 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.105 0.479 . . . . 0.0 110.316 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' MET . . . . . 0.546 ' HB2' ' HD3' ' A' ' 81' ' ' PRO . 1.6 mpp? -94.53 3.22 55.4 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.587 -177.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.585 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -57.85 -33.7 69.11 Favored Glycine 0 C--O 1.226 -0.369 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.52 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.48 -31.25 62.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.864 0.364 . . . . 0.0 111.143 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.461 ' HG3' ' HA ' ' B' ' 3' ' ' MET . 4.8 mmtt -72.29 -58.06 3.71 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.837 -0.62 . . . . 0.0 112.269 -172.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.585 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.1 p90 -73.69 -27.09 61.04 Favored 'General case' 0 C--N 1.332 -0.193 0 C-N-CA 120.013 -0.675 . . . . 0.0 111.26 -175.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -53.27 -47.12 69.38 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 123.425 0.453 . . . . 0.0 110.425 -177.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.9 -43.55 86.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.322 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.53 -42.97 77.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.75 179.077 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' PHE . . . . . 0.477 ' HA ' ' OH ' ' A' ' 105' ' ' TYR . 1.0 OUTLIER -55.33 -48.76 73.69 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 121.307 0.575 . . . . 0.0 110.398 178.101 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' LYS . . . . . 0.646 ' HE2' ' HB2' ' A' ' 71' ' ' GLU . 1.8 tppt? -65.8 -26.05 67.52 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.94 179.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -73.19 -41.63 63.62 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.143 0.497 . . . . 0.0 111.061 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 7.9 mt-30 -71.55 -49.14 43.51 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.272 177.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.795 HG11 ' HG2' ' A' ' 71' ' ' GLU . 1.2 t -64.45 -34.35 68.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.338 -0.846 . . . . 0.0 112.03 -174.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.584 ' HD2' ' HG3' ' B' ' 12' ' ' LYS . 0.2 OUTLIER -68.35 -38.9 81.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.692 0.282 . . . . 0.0 111.187 -178.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.27 -32.32 68.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.806 -177.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.49 -32.81 73.88 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.082 -0.508 . . . . 0.0 112.141 -177.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.43 -23.77 42.94 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 121.456 0.646 . . . . 0.0 110.803 173.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -85.67 -14.01 46.83 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.957 -175.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -73.99 -20.39 60.35 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.275 -0.421 . . . . 0.0 112.115 -174.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.593 ' HG3' ' HB2' ' B' ' 112' ' ' ASN . 3.4 ptm -122.45 177.77 5.26 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 120.91 0.386 . . . . 0.0 111.503 -178.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 25.9 t -74.49 110.62 9.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.595 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -80.03 109.08 14.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.688 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' B' ' 25' ' ' LEU . 2.7 mt -112.16 -168.76 1.36 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.052 0.453 . . . . 0.0 110.513 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 1.1 p -129.82 144.61 53.7 Favored Pre-proline 0 C--N 1.321 -0.67 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.424 ' HA ' ' HB3' ' B' ' 30' ' ' ALA . 7.9 Cg_endo -52.76 -17.18 6.82 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 123.34 2.693 . . . . 0.0 113.817 -176.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 12.3 mtmm -73.05 -47.08 47.79 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.179 0.514 . . . . 0.0 110.946 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.47 -33.22 42.52 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.725 178.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.537 ' O ' ' HG ' ' B' ' 34' ' ' LEU . . . -64.21 -47.02 81.33 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.579 179.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' TYR . . . . . 0.672 ' HA ' HD12 ' B' ' 34' ' ' LEU . 39.0 t80 -66.92 -30.95 71.23 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.774 -0.37 . . . . 0.0 110.714 178.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.93 -47.15 87.72 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.666 0.27 . . . . 0.0 111.32 -179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.608 HD13 HG21 ' B' ' 40' ' ' ILE . 0.3 OUTLIER -70.03 -26.57 64.1 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.088 -0.245 . . . . 0.0 110.991 178.934 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.672 HD12 ' HA ' ' B' ' 31' ' ' TYR . 51.7 mt -72.43 -45.36 59.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.095 0.474 . . . . 0.0 110.705 177.158 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -73.59 -24.12 60.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.094 -174.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -105.13 -9.59 17.68 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . 0.555 ' HB2' ' O ' ' B' ' 33' ' ' LEU . 42.7 m-20 -129.47 111.18 17.8 Favored Pre-proline 0 C--N 1.327 -0.401 0 CA-C-O 120.731 0.3 . . . . 0.0 110.525 178.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_exo -71.9 -1.63 10.25 Favored 'Trans proline' 0 CA--C 1.531 0.361 0 C-N-CA 123.155 2.57 . . . . 0.0 112.801 -178.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 2.9 t0 -105.78 -26.31 11.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.542 -177.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.608 HG21 HD13 ' B' ' 33' ' ' LEU . 36.1 mt -77.53 110.58 13.37 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 175.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . . . . . . . . . 1.1 m -100.64 144.67 29.34 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.791 -173.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.841 HD11 ' HB2' ' B' ' 88' ' ' PHE . 3.1 tp -104.85 125.31 50.75 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . . . . . . . . . 1.3 mp -104.34 114.05 42.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 175.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.827 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.0 OUTLIER -102.8 133.9 47.08 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.446 -178.849 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . 0.493 ' O ' ' HG2' ' B' ' 46' ' ' ARG . 0.1 OUTLIER -122.13 97.86 5.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.331 -0.85 . . . . 0.0 109.547 -178.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . 0.584 ' HD2' ' S1 ' ' B' ' 139' ' ' PS5 . 0.0 OUTLIER -149.21 164.35 35.02 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.731 -178.54 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -71.55 137.01 83.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.668 0.271 . . . . 0.0 110.961 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -65.04 -26.68 58.02 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 122.688 2.258 . . . . 0.0 113.54 -177.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . 0.653 ' HA ' ' HD3' ' B' ' 52' ' ' LYS . 4.2 t0 -78.39 -33.25 48.94 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.647 -0.421 . . . . 0.0 110.233 176.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' GLU . . . . . 0.482 ' CD ' HH21 ' B' ' 46' ' ' ARG . 3.5 mt-10 -65.14 -34.76 79.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.073 172.269 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.872 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 1.3 mp -65.42 -35.12 79.97 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.432 177.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' LYS . . . . . 0.653 ' HD3' ' HA ' ' B' ' 49' ' ' ASP . 0.0 OUTLIER -69.62 -39.97 76.88 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.436 178.324 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.11 -48.31 13.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 112.609 -173.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -97.52 -35.01 10.78 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.492 -172.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.12 172.72 14.93 Favored Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 120.91 -0.662 . . . . 0.0 111.794 -178.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' LYS . . . . . 0.872 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 11.9 pttt -140.47 155.31 69.91 Favored Pre-proline 0 C--N 1.321 -0.631 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 178.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.407 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 11.8 Cg_endo -59.02 124.26 15.29 Favored 'Trans proline' 0 C--N 1.344 0.291 0 C-N-CA 122.51 2.14 . . . . 0.0 112.684 -177.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . 0.711 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 33.8 t0 -97.25 73.76 2.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.344 0.592 . . . . 0.0 110.486 178.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.624 HG22 ' HB2' ' B' ' 62' ' ' TYR . 2.8 m -113.31 171.26 3.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 176.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -30.07 55.79 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.979 0.419 . . . . 0.0 111.364 -174.818 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -122.55 65.23 0.95 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.481 0.658 . . . . 0.0 110.649 -177.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.827 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 1.2 t80 -114.85 125.29 53.5 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.477 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.424 ' HB3' ' HE1' ' B' ' 65' ' ' MET . 2.1 mttt -123.55 119.59 30.36 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.453 -0.339 . . . . 0.0 110.437 179.228 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -80.93 115.48 20.42 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' MET . . . . . 0.773 ' HG3' ' HB3' ' B' ' 73' ' ' LEU . 0.0 OUTLIER -113.34 91.24 3.58 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.757 -0.46 . . . . 0.0 109.757 179.443 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -121.99 88.59 2.96 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.049 0.452 . . . . 0.0 111.917 -173.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.0 -128.64 0.29 Allowed 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 108.509 -0.923 . . . . 0.0 108.509 170.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . -84.37 -43.72 6.87 Favored Glycine 0 N--CA 1.446 -0.682 0 N-CA-C 109.305 -1.518 . . . . 0.0 109.305 168.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' LYS . . . . . 0.887 ' HA ' ' HE3' ' B' ' 69' ' ' LYS . 0.0 OUTLIER -148.02 44.71 1.08 Allowed 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.45 -0.875 . . . . 0.0 109.439 170.449 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.704 ' HB2' ' HB3' ' B' ' 65' ' ' MET . 0.1 OUTLIER 59.65 -2.58 0.13 Allowed 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 175.476 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.746 ' HG2' HG11 ' A' ' 15' ' ' VAL . 0.3 OUTLIER -45.39 -60.71 2.98 Favored Pre-proline 0 CA--C 1.543 0.697 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -176.16 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.596 ' HD3' ' HB2' ' B' ' 71' ' ' GLU . 11.8 Cg_exo -73.24 -16.09 25.16 Favored 'Trans proline' 0 C--N 1.351 0.71 0 C-N-CA 122.576 2.184 . . . . 0.0 113.225 -178.408 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.773 ' HB3' ' HG3' ' B' ' 65' ' ' MET . 0.3 OUTLIER -85.53 -15.79 41.61 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.142 -175.805 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.949 HD21 HD21 ' B' ' 102' ' ' LEU . 9.5 tp -58.56 -49.19 78.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.262 0.553 . . . . 0.0 110.807 -179.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.32 -26.57 66.58 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.333 -179.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -74.43 -29.59 61.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.158 -0.473 . . . . 0.0 112.009 -175.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.54 -34.51 67.58 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.925 0.393 . . . . 0.0 111.096 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.91 50.47 2.86 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.59 -0.815 . . . . 0.0 111.284 -175.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 20.0 mt -97.23 148.42 23.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.778 0.323 . . . . 0.0 110.614 -178.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.462 ' HA ' ' HD3' ' B' ' 81' ' ' PRO . 0.5 OUTLIER -136.38 137.54 24.57 Favored Pre-proline 0 C--N 1.321 -0.652 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 175.538 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' B' ' 80' ' ' ASP . 30.1 Cg_exo -67.23 24.17 0.11 Allowed 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 123.416 2.744 . . . . 0.0 114.222 -174.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.6 4.01 23.52 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.33 0.586 . . . . 0.0 109.793 174.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.453 ' HA ' ' HD3' ' B' ' 84' ' ' PRO . 1.2 mttp -119.17 132.86 23.8 Favored Pre-proline 0 C--N 1.327 -0.404 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.16 -177.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' B' ' 83' ' ' LYS . 6.1 Cg_exo -69.62 143.01 50.15 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.453 2.102 . . . . 0.0 110.865 174.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.557 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 2.1 m -141.47 151.28 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 120.993 0.425 . . . . 0.0 111.351 -176.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.481 HG23 ' HB2' ' B' ' 111' ' ' TYR . 2.8 p -127.46 142.79 42.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 175.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.806 ' HB ' ' HB1' ' B' ' 95' ' ' ALA . 18.6 m -104.93 157.9 5.77 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.841 ' HB2' HD11 ' B' ' 42' ' ' LEU . 4.4 t80 -122.99 111.4 16.56 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 113.361 0.875 . . . . 0.0 113.361 -175.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 4.5 t 87.29 99.43 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 125.171 1.389 . . . . 0.0 112.781 176.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.489 ' H ' ' HG3' ' B' ' 90' ' ' LYS . 0.0 OUTLIER -80.54 2.38 25.68 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.587 173.749 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.06 158.28 15.53 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.829 -178.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . 58.31 -87.66 0.02 OUTLIER 'General case' 0 C--O 1.237 0.399 0 C-N-CA 123.285 0.634 . . . . 0.0 112.296 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' B' ' 94' ' ' ARG . . . -70.6 -27.62 64.23 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.65 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' ARG . . . . . 0.737 ' HG3' ' HE2' ' A' ' 69' ' ' LYS . 0.8 OUTLIER 69.99 84.78 0.14 Allowed 'General case' 0 C--O 1.232 0.182 0 O-C-N 124.014 0.821 . . . . 0.0 111.822 177.344 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . 0.806 ' HB1' ' HB ' ' B' ' 87' ' ' VAL . . . -66.22 -12.65 57.42 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.807 175.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -58.6 -30.16 67.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.919 178.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' B' ' 97' ' ' LEU . 2.1 mm? -76.27 -28.07 56.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.271 175.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' ALA . . . . . 0.611 ' HA ' HD21 ' B' ' 70' ' ' LEU . . . -72.44 -30.94 65.05 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.321 -179.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 99' ' ' GLY . . . . . 0.449 ' HA3' ' CE ' ' B' ' 22' ' ' MET . . . -103.76 -46.22 1.42 Allowed Glycine 0 N--CA 1.447 -0.632 0 C-N-CA 120.388 -0.91 . . . . 0.0 113.727 -174.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 100' ' ' LYS . . . . . 0.429 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -62.46 -33.12 74.2 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 122.571 -0.37 . . . . 0.0 111.142 -174.832 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . 0.429 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 1.2 m -73.46 -36.29 65.83 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.941 0.4 . . . . 0.0 111.061 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.949 HD21 HD21 ' B' ' 74' ' ' LEU . 5.6 mt -67.78 -38.53 83.51 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.258 -176.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.2 -26.13 67.25 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 120.917 0.389 . . . . 0.0 110.612 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -77.43 -5.58 50.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.273 176.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . 0.417 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 22.0 m-30 -105.8 -8.14 17.93 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.078 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 123.73 5.05 7.81 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.012 -1.09 . . . . 0.0 113.734 171.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' PHE . . . . . 0.418 ' CE1' HD22 ' B' ' 102' ' ' LEU . 8.7 m-85 -69.4 130.54 42.81 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 117.034 0.417 . . . . 0.0 110.589 -179.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 7.8 tttm -57.58 -80.76 0.02 OUTLIER 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.231 -0.895 . . . . 0.0 112.087 -172.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.06 115.7 26.57 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.968 -177.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' ILE . . . . . 0.557 ' HA ' ' O ' ' B' ' 85' ' ' VAL . 1.4 tt -118.92 127.37 75.78 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.604 -177.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' TYR . . . . . 0.481 ' HB2' HG23 ' B' ' 86' ' ' VAL . 4.7 m-85 -113.39 144.5 42.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.387 -175.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.593 ' HB2' ' HG3' ' B' ' 22' ' ' MET . 17.9 t-20 -117.62 143.41 46.16 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 109.146 -0.686 . . . . 0.0 109.146 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.611 ' OG ' ' HA ' ' B' ' 88' ' ' PHE . 0.0 OUTLIER -83.06 134.32 35.03 Favored 'General case' 0 C--N 1.311 -1.108 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.633 -175.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.69 153.91 20.36 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.826 -1.079 . . . . 0.0 108.373 164.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . 0.597 ' HA3' ' HD3' ' B' ' 119' ' ' LYS . . . 82.9 -108.44 2.98 Favored Glycine 0 N--CA 1.443 -0.861 0 N-CA-C 111.139 -0.784 . . . . 0.0 111.139 -173.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . . . . . . . . . . . 160.15 -156.14 27.35 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.658 -0.782 . . . . 0.0 111.75 176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 117' ' ' MET . . . . . . . . . . . . . 1.6 ttt -61.43 -35.21 76.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.961 0.41 . . . . 0.0 110.377 178.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.534 ' HB3' ' S4 ' ' B' ' 139' ' ' PS5 . 0.2 OUTLIER -57.8 -38.57 75.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.639 177.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 119' ' ' LYS . . . . . 0.597 ' HD3' ' HA3' ' B' ' 115' ' ' GLY . 0.0 OUTLIER -66.46 -33.21 75.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.805 -179.495 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.679 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 30.7 t-105 -59.99 -53.62 55.65 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 177.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' B' ' 121' ' ' LEU . 12.8 mt -64.31 -39.69 94.43 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.861 177.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -61.59 -40.64 95.5 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.957 0.408 . . . . 0.0 111.369 -178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -74.05 -12.49 60.63 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.883 0.373 . . . . 0.0 110.802 -179.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 74.33 33.2 56.98 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.572 -178.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.45 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 83.7 mt -80.34 159.3 70.35 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.655 -0.273 . . . . 0.0 110.607 -178.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 14.3 Cg_endo -54.57 119.36 6.29 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 123.09 2.526 . . . . 0.0 112.163 -179.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -132.48 152.75 51.42 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.316 -177.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 128' ' ' LEU . . . . . 0.711 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 3.2 mt -102.31 102.02 12.35 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 176.607 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -135.63 136.5 41.05 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.156 -175.394 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 31.3 mtp180 -89.11 78.92 7.31 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 1.7 m -45.16 123.93 4.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 114.831 -1.077 . . . . 0.0 112.725 -171.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 132' ' ' HIS . . . . . 0.583 ' HB3' ' HB2' ' B' ' 135' ' ' HIS . 45.3 m170 -82.52 69.47 9.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.042 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 37.7 t-80 -65.2 -37.06 86.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.586 -175.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -94.84 2.64 55.47 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -174.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 135' ' ' HIS . . . . . 0.583 ' HB2' ' HB3' ' B' ' 132' ' ' HIS . 1.1 t60 -79.58 65.71 4.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.02 0.438 . . . . 0.0 111.012 179.064 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -77.4 -31.12 53.92 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.903 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.084 0 CA-C-O 117.926 -1.035 . . . . 0.0 109.184 175.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' PS5 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 139' ' ' PS5 . . . . . 0.584 ' S1 ' ' HD2' ' B' ' 46' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.445 ' HB1' ' SD ' ' A' ' 3' ' ' MET . . . . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 120.924 0.392 . . . . 0.0 110.342 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -80.43 67.21 6.2 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.317 0.579 . . . . 0.0 110.015 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.445 ' SD ' ' HB1' ' A' ' 1' ' ' ALA . 0.0 OUTLIER -95.86 19.02 12.04 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.563 -173.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.603 ' HA2' ' CE1' ' A' ' 7' ' ' PHE . . . -63.61 -52.27 47.4 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.808 -0.71 . . . . 0.0 112.041 178.689 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -59.75 -32.46 70.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.27 0.557 . . . . 0.0 110.528 175.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.1 mmtt -66.42 -57.51 7.24 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.055 -175.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.603 ' CE1' ' HA2' ' A' ' 4' ' ' GLY . 0.3 OUTLIER -84.28 -22.7 30.64 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 -175.624 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.627 ' HB2' ' HB2' ' B' ' 75' ' ' ALA . 17.5 t70 -54.27 -41.94 69.41 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 121.232 0.539 . . . . 0.0 111.023 -177.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.83 -37.7 67.38 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.137 178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.2 -43.11 82.93 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.475 -177.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.412 ' HA ' ' OH ' ' B' ' 105' ' ' TYR . 0.8 OUTLIER -58.18 -41.68 84.43 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.153 0.501 . . . . 0.0 110.093 -179.309 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.594 ' HE2' ' HG3' ' B' ' 72' ' ' PRO . 12.2 tptp -64.88 -26.68 68.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.164 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.97 -46.34 30.17 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.492 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -70.59 -51.86 25.41 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.798 -176.017 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.4 t -58.47 -34.32 50.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.898 0.38 . . . . 0.0 110.865 -178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 12' ' ' LYS . 1.5 tptm -62.08 -36.08 80.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.395 177.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.62 -26.01 68.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.281 -179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.83 -31.91 71.24 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.656 176.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 7.2 mtpp -75.86 -21.06 57.6 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.46 0.648 . . . . 0.0 110.819 173.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.25 -21.46 46.14 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.279 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -75.64 -15.28 60.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.889 -176.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.686 ' HG3' HG23 ' A' ' 110' ' ' ILE . 1.5 mpp? -121.58 -179.45 4.1 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.965 0.412 . . . . 0.0 111.237 -177.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 8.5 t -88.22 105.81 15.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.61 175.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.801 ' HG3' ' HG2' ' A' ' 114' ' ' GLU . 0.0 OUTLIER -73.45 100.04 3.14 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.856 0.36 . . . . 0.0 110.29 -177.627 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.493 ' HA ' HD23 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -116.27 142.51 46.74 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.193 0.52 . . . . 0.0 111.127 -175.743 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -81.18 138.41 48.96 Favored Pre-proline 0 C--N 1.321 -0.673 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.853 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.58 ' HA ' ' HB3' ' A' ' 30' ' ' ALA . 10.1 Cg_endo -52.65 -14.46 3.28 Favored 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.697 2.932 . . . . 0.0 114.308 -176.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.42 -45.78 52.47 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.836 0.351 . . . . 0.0 110.795 175.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.434 ' O ' ' HG ' ' A' ' 33' ' ' LEU . 1.0 OUTLIER -79.6 -33.34 41.64 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.544 176.175 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.58 ' HB3' ' HA ' ' A' ' 27' ' ' PRO . . . -62.43 -39.52 93.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.453 179.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.498 ' HA ' ' HB2' ' A' ' 34' ' ' LEU . 63.5 t80 -74.19 -32.56 63.12 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.686 177.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.36 -51.55 67.87 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.92 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.683 ' HB2' HD12 ' A' ' 40' ' ' ILE . 0.1 OUTLIER -73.85 -27.54 61.14 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.72 0.295 . . . . 0.0 110.864 178.509 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.855 HD11 ' HB2' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -61.55 -50.59 72.06 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.207 0.527 . . . . 0.0 110.838 178.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.3 -27.5 56.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.102 -177.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -76.75 -31.9 57.39 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.77 0.319 . . . . 0.0 111.067 -177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.76 ' HB2' HG13 ' A' ' 40' ' ' ILE . 44.6 m-20 -119.73 114.42 34.15 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.842 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 37' ' ' ASN . 15.6 Cg_exo -68.74 -0.27 5.86 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 123.197 2.598 . . . . 0.0 112.925 -179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -105.36 -18.48 14.1 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.193 179.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.82 HG12 ' HG2' ' A' ' 84' ' ' PRO . 0.9 OUTLIER -74.27 114.37 13.94 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.366 0 N-CA-C 109.496 -0.557 . . . . 0.0 109.496 174.615 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.529 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -107.64 140.04 41.26 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.793 -177.085 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.855 ' HB2' HD11 ' A' ' 34' ' ' LEU . 10.7 tp -103.93 120.92 42.04 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 174.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.562 HD11 HD21 ' A' ' 79' ' ' LEU . 1.3 mp -104.35 113.74 42.11 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 176.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.639 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 2.2 t70 -102.47 140.25 37.0 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.725 -178.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -122.75 93.48 2.48 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-O 121.622 0.725 . . . . 0.0 109.777 173.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.552 ' HA ' HH21 ' A' ' 94' ' ' ARG . 11.9 mmm180 -143.27 152.64 41.92 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.415 178.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -77.94 142.07 64.29 Favored Pre-proline 0 C--N 1.317 -0.833 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.498 -173.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -59.86 -25.28 78.92 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 123.37 2.714 . . . . 0.0 113.565 -172.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.81 -38.45 46.47 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.791 -0.364 . . . . 0.0 111.212 -179.294 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.417 ' CD ' HH12 ' A' ' 46' ' ' ARG . 0.4 OUTLIER -72.91 -37.44 67.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 175.268 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.968 ' HG ' ' HB3' ' A' ' 56' ' ' LYS . 1.3 tp -59.35 -33.31 71.0 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.519 174.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 -37.59 60.46 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.132 178.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -78.48 -49.66 13.02 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -174.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -100.11 -35.8 9.55 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.289 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.15 178.48 15.33 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.176 -0.535 . . . . 0.0 112.459 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.968 ' HB3' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -140.58 154.06 68.83 Favored Pre-proline 0 C--N 1.324 -0.539 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 177.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.429 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 11.6 Cg_endo -61.38 123.27 12.46 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 121.976 1.784 . . . . 0.0 112.674 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.511 ' HB3' ' HB2' ' A' ' 126' ' ' PRO . 46.7 t0 -86.54 93.56 9.21 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 174.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 1.041 HG23 ' HB2' ' A' ' 62' ' ' TYR . 0.0 OUTLIER -129.84 151.42 35.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.234 -177.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.91 -33.87 76.82 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.172 0.51 . . . . 0.0 110.911 -178.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -116.95 66.84 0.72 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.356 -178.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 1.041 ' HB2' HG23 ' A' ' 59' ' ' VAL . 12.2 t80 -108.38 122.52 47.17 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.611 -176.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.529 ' HE2' HG21 ' A' ' 41' ' ' THR . 18.9 mttm -122.83 109.31 14.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 175.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 11.1 t-160 -93.11 114.53 27.07 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . 0.547 ' HG3' ' HB3' ' A' ' 73' ' ' LEU . 0.0 OUTLIER -102.55 171.28 7.53 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.841 0.353 . . . . 0.0 110.326 179.872 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . 0.708 ' HA ' ' NH2' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -75.23 168.54 19.79 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 174.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.708 ' NH2' ' HA ' ' A' ' 66' ' ' SER . 0.0 OUTLIER -87.07 -47.29 9.04 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.006 0.432 . . . . 0.0 110.881 -176.082 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -100.63 -35.52 4.33 Favored Glycine 0 N--CA 1.442 -0.908 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.16 29.82 1.35 Allowed 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.446 -0.377 . . . . 0.0 110.561 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.531 ' HG ' ' N ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -71.09 -41.38 70.71 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 177.402 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.531 ' N ' ' HG ' ' A' ' 70' ' ' LEU . 0.0 OUTLIER -47.31 -53.89 25.49 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.445 -0.798 . . . . 0.0 112.369 -175.626 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.504 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 73.9 Cg_endo -73.76 -16.73 23.44 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 122.076 1.851 . . . . 0.0 112.983 179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.547 ' HB3' ' HG3' ' A' ' 65' ' ' MET . 0.4 OUTLIER -88.44 -15.74 34.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.671 0.272 . . . . 0.0 111.021 -177.809 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.887 HD21 HD21 ' A' ' 102' ' ' LEU . 6.3 tp -58.42 -53.49 57.67 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.176 0.512 . . . . 0.0 111.024 -178.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -71.47 -27.06 62.98 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.317 -179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.6 -28.79 62.01 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.84 -179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.509 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 41.2 m -77.41 -38.08 50.47 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.14 0.495 . . . . 0.0 109.957 178.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 98.24 81.25 1.58 Allowed Glycine 0 N--CA 1.444 -0.817 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.269 177.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.562 HD21 HD11 ' A' ' 43' ' ' ILE . 29.1 mt -122.36 148.64 44.82 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 178.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.476 ' OD2' ' HG3' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -128.06 138.93 34.0 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -70.54 -0.82 8.14 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 C-N-CA 122.919 2.413 . . . . 0.0 114.266 -170.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.563 ' HA ' ' HG3' ' A' ' 108' ' ' LYS . 38.3 mm-40 -100.03 9.34 43.04 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.133 0.492 . . . . 0.0 109.997 175.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.476 ' HG3' ' OD2' ' A' ' 80' ' ' ASP . 7.2 mttm -102.82 128.11 28.58 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.235 -178.165 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.82 ' HG2' HG12 ' A' ' 40' ' ' ILE . 72.9 Cg_endo -72.96 122.06 7.81 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 122.409 2.072 . . . . 0.0 110.806 174.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.474 HG12 ' HB ' ' A' ' 41' ' ' THR . 1.8 m -130.56 152.62 37.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 CA-C-O 121.029 0.443 . . . . 0.0 111.371 -173.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.607 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 1.2 p -127.07 142.49 43.34 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 16.4 m -104.33 135.82 40.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.124 0.488 . . . . 0.0 110.556 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.823 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.9 t80 -119.48 144.65 46.88 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.753 -177.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' CYS . . . . . 0.626 ' HB3' ' HB2' ' A' ' 95' ' ' ALA . 52.7 t 176.73 -73.97 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.446 179.157 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.725 ' HA ' ' HA3' ' A' ' 116' ' ' GLY . 0.6 OUTLIER -162.46 -149.91 0.16 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.423 175.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . 0.608 ' H ' ' HD3' ' A' ' 90' ' ' LYS . 0.2 OUTLIER -109.02 28.06 8.87 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 112.443 0.535 . . . . 0.0 112.443 -174.037 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -127.32 -177.1 3.94 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.782 0.66 . . . . 0.0 112.782 -175.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.434 ' HA ' ' HB3' ' A' ' 96' ' ' ALA . . . -60.04 -26.52 66.19 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 114.956 -1.02 . . . . 0.0 112.667 -176.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 0.581 ' HB3' ' S1 ' ' A' ' 138' ' ' PS5 . 1.7 ttt180 -49.47 -46.71 48.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.636 0.255 . . . . 0.0 111.618 -177.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.626 ' HB2' ' HB3' ' A' ' 89' ' ' CYS . . . -77.13 -35.41 56.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.117 0.484 . . . . 0.0 110.627 176.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.434 ' HB3' ' HA ' ' A' ' 93' ' ' ALA . . . -59.71 -27.91 66.87 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.174 -178.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.453 HD21 HD21 ' B' ' 97' ' ' LEU . 2.8 mm? -67.59 -35.27 78.67 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.838 -0.345 . . . . 0.0 110.407 179.297 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -73.73 -45.63 50.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.913 0.387 . . . . 0.0 110.427 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -70.21 -53.45 13.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.031 -0.604 . . . . 0.0 113.57 -177.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.504 ' HG3' ' N ' ' A' ' 101' ' ' THR . 0.0 OUTLIER -62.3 -35.81 80.19 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.704 -0.292 . . . . 0.0 111.408 -174.245 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.504 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 23.4 m -70.75 -35.57 72.71 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.826 0.346 . . . . 0.0 110.8 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.887 HD21 HD21 ' A' ' 74' ' ' LEU . 13.1 mt -66.36 -47.77 72.35 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.84 0.352 . . . . 0.0 111.083 177.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.709 ' HB3' HG21 ' A' ' 110' ' ' ILE . 0.6 OUTLIER -67.79 -26.17 65.96 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.966 0.413 . . . . 0.0 110.356 178.535 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.67 -8.08 32.08 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.395 175.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -108.81 -12.03 14.96 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.576 0.226 . . . . 0.0 111.385 -179.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 118.58 18.5 4.83 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.072 -1.061 . . . . 0.0 113.343 175.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.443 ' CE1' HD22 ' A' ' 102' ' ' LEU . 4.2 m-85 -66.2 140.16 58.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.307 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.563 ' HG3' ' HA ' ' A' ' 82' ' ' GLU . 14.5 mtpp -62.69 -84.69 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.004 -0.543 . . . . 0.0 112.194 -171.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -113.39 109.85 19.36 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.686 -177.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.709 HG21 ' HB3' ' A' ' 103' ' ' ARG . 1.3 tt -114.71 128.74 71.68 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-O 121.154 0.502 . . . . 0.0 111.247 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.607 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 12.0 m-85 -113.36 139.67 48.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.433 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -115.98 144.41 44.11 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 175.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.05 130.12 34.87 Favored 'General case' 0 C--N 1.322 -0.608 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.867 -173.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.801 ' HG2' ' HG3' ' A' ' 24' ' ' MET . 0.0 OUTLIER -96.09 17.29 15.87 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.374 172.777 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.46 -70.63 0.12 Allowed Glycine 0 N--CA 1.442 -0.944 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.836 179.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.725 ' HA3' ' HA ' ' A' ' 90' ' ' LYS . . . 114.59 177.71 18.96 Favored Glycine 0 N--CA 1.443 -0.844 0 C-N-CA 120.606 -0.807 . . . . 0.0 112.08 179.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' MET . . . . . 0.552 ' HA ' ' CE2' ' A' ' 88' ' ' PHE . 0.0 OUTLIER -57.73 -37.98 74.5 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.822 0.344 . . . . 0.0 111.11 -178.199 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -63.53 -28.52 70.0 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.505 179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -75.38 -31.95 60.65 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.37 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.69 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -57.24 -53.35 59.12 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 62.4 mt -63.21 -37.4 87.08 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.555 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -60.23 -40.09 89.0 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.718 -179.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.504 ' HB2' ' HG ' ' A' ' 125' ' ' LEU . 38.6 mm-40 -81.89 -3.08 53.3 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.251 -177.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 68.98 32.46 73.33 Favored Glycine 0 N--CA 1.45 -0.432 0 N-CA-C 111.385 -0.686 . . . . 0.0 111.385 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.575 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 76.6 mt -78.82 163.26 61.58 Favored Pre-proline 0 C--N 1.323 -0.574 0 CA-C-N 115.556 -0.322 . . . . 0.0 110.359 -178.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.575 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 28.2 Cg_endo -57.53 113.26 1.42 Allowed 'Trans proline' 0 CA--C 1.517 -0.338 0 C-N-CA 122.824 2.35 . . . . 0.0 111.484 178.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 8.9 m -121.09 151.07 40.28 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 109.952 -0.388 . . . . 0.0 109.952 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.779 ' HB3' ' HE2' ' A' ' 56' ' ' LYS . 1.3 mt -98.92 101.35 12.72 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.838 179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -122.41 144.77 48.83 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 178.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -55.67 103.24 0.09 Allowed 'General case' 0 C--N 1.328 -0.335 0 O-C-N 123.429 0.455 . . . . 0.0 109.858 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.41 129.69 36.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.951 -169.094 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 50.6 t60 -79.4 84.52 5.29 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.749 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.78 170.26 22.86 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.241 -179.193 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 88.9 m-70 -81.19 66.75 6.85 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 175.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 86.8 t60 -133.42 111.96 11.18 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.683 -172.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -84.92 170.33 13.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.397 177.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 8.5 t-80 . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.439 -0.791 . . . . 0.0 109.967 177.973 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.946 0 CA-C-O 120.922 0.391 . . . . 0.0 110.573 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -86.6 76.58 9.53 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.101 0.477 . . . . 0.0 110.429 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' MET . . . . . . . . . . . . . 1.6 ttm -92.67 19.57 7.32 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.316 -176.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.71 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -55.13 -34.96 59.02 Favored Glycine 0 C--O 1.227 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.427 -179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.58 -32.24 71.34 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 122.946 0.498 . . . . 0.0 111.628 176.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . . . . . . . . . 6.8 mmmt -72.79 -57.93 3.72 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.133 -174.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.71 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 4.3 p90 -74.75 -25.66 59.24 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.007 -0.677 . . . . 0.0 111.521 -176.417 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -53.71 -52.47 59.96 Favored 'General case' 0 N--CA 1.467 0.407 0 O-C-N 123.361 0.413 . . . . 0.0 110.553 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.81 -44.3 77.64 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.84 -179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.74 -42.29 86.49 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 111.741 0.274 . . . . 0.0 111.741 -175.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' PHE . . . . . 0.403 ' CZ ' HD21 ' A' ' 70' ' ' LEU . 0.6 OUTLIER -53.5 -43.81 68.54 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.221 0.534 . . . . 0.0 110.704 -178.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -24.58 65.7 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.258 177.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.66 -48.78 36.4 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.866 0.365 . . . . 0.0 110.81 176.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -67.69 -51.41 49.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.303 -179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -56.69 -34.1 41.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.935 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.436 ' HB3' ' HE2' ' B' ' 16' ' ' LYS . 5.9 mtpt -66.63 -39.43 88.27 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.741 0.305 . . . . 0.0 111.16 176.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.93 -26.89 68.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.573 -178.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.45 -33.3 64.82 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.116 178.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.658 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 0.1 OUTLIER -75.94 -21.25 57.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.125 0.488 . . . . 0.0 110.928 174.874 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -71.96 -19.16 61.94 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.261 -0.882 . . . . 0.0 112.026 -174.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -91.5 -1.18 57.62 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -176.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.856 ' HG3' HG23 ' B' ' 110' ' ' ILE . 1.5 mpp? -120.47 165.93 14.29 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.83 0.348 . . . . 0.0 111.343 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 15.4 t -80.99 103.27 7.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 172.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' MET . . . . . 0.658 ' SD ' ' HB3' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -79.14 107.21 11.73 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.997 0.427 . . . . 0.0 110.672 -174.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.516 ' O ' ' HA ' ' B' ' 113' ' ' SER . 7.1 mt -126.73 142.08 51.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.662 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.48 151.8 85.33 Favored Pre-proline 0 C--N 1.317 -0.81 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.203 179.286 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.428 ' HB2' ' CD1' ' B' ' 125' ' ' LEU . 4.7 Cg_endo -47.66 -31.33 14.14 Favored 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 123.854 3.036 . . . . 0.0 114.372 -177.176 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.854 ' HD3' ' HG2' ' B' ' 123' ' ' GLU . 1.3 mtmm -74.43 -42.67 58.75 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.088 0.471 . . . . 0.0 110.791 177.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 41.2 m-20 -70.94 -32.44 69.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.117 -179.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.26 -44.05 69.27 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.464 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' TYR . . . . . 0.595 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 74.3 t80 -67.03 -30.47 70.56 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.204 179.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 9.5 tttp -57.09 -52.85 63.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.035 -179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.719 ' HB2' HD12 ' B' ' 40' ' ' ILE . 0.1 OUTLIER -73.9 -27.75 61.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.409 -0.359 . . . . 0.0 110.677 178.321 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.695 HD11 ' HB2' ' B' ' 42' ' ' LEU . 1.1 mt -61.73 -55.8 26.43 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.945 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -76.06 -22.19 55.94 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.057 -0.52 . . . . 0.0 111.775 -173.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -86.84 -31.78 20.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.964 0.411 . . . . 0.0 110.555 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 43.3 m-80 -121.3 102.94 42.42 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.437 179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . 0.545 ' HA ' ' ND2' ' B' ' 61' ' ' ASN . 17.1 Cg_exo -68.27 5.81 1.08 Allowed 'Trans proline' 0 N--CA 1.473 0.281 0 C-N-CA 123.261 2.641 . . . . 0.0 112.545 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -91.83 -27.56 17.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.583 174.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.719 HD12 ' HB2' ' B' ' 33' ' ' LEU . 9.2 mt -82.37 109.2 16.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.688 175.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.417 HG21 ' HE2' ' B' ' 63' ' ' LYS . 1.2 m -100.25 145.22 28.35 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.672 -176.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.996 HD11 ' HB2' ' B' ' 88' ' ' PHE . 12.2 tp -101.1 122.58 43.84 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 175.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.479 HG23 ' HE3' ' B' ' 65' ' ' MET . 79.7 mt -103.85 111.16 32.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.93 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.213 176.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.833 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.2 OUTLIER -98.96 129.43 45.27 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 179.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.68 96.64 4.56 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.366 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . 0.568 ' HG2' ' SG ' ' B' ' 89' ' ' CYS . 0.0 OUTLIER -155.75 167.0 31.82 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.369 -177.464 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.47 ' H ' ' HD2' ' B' ' 46' ' ' ARG . 0.7 OUTLIER -75.6 125.66 88.31 Favored Pre-proline 0 C--N 1.314 -0.941 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.125 -176.439 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' B' ' 51' ' ' LEU . 18.4 Cg_endo -65.43 -19.79 61.22 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.901 2.401 . . . . 0.0 113.472 -172.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.66 -46.15 73.2 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.975 0.417 . . . . 0.0 110.472 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -73.05 -34.07 66.07 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.582 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.859 ' HG ' ' HB3' ' B' ' 56' ' ' LYS . 0.5 OUTLIER -58.87 -45.77 89.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.467 0.651 . . . . 0.0 110.253 176.597 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 29.7 mtpt -66.53 -37.01 84.1 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 -178.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.4 -48.41 10.38 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -174.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -95.1 -35.79 11.76 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.623 -0.431 . . . . 0.0 111.932 -172.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 135.64 159.36 8.53 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.288 -0.958 . . . . 0.0 113.125 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' LYS . . . . . 0.859 ' HB3' ' HG ' ' B' ' 51' ' ' LEU . 0.0 OUTLIER -139.49 154.99 72.04 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 178.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -57.06 123.23 13.36 Favored 'Trans proline' 0 C--N 1.343 0.268 0 C-N-CA 122.278 1.986 . . . . 0.0 112.562 -178.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -101.83 74.99 1.51 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.2 0.524 . . . . 0.0 109.954 179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.593 HG22 ' HB2' ' B' ' 62' ' ' TYR . 3.1 m -115.95 167.92 8.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.837 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.12 -41.53 99.35 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.942 -175.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.545 ' ND2' ' HA ' ' B' ' 38' ' ' PRO . 0.0 OUTLIER -122.49 77.34 1.41 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.362 0.601 . . . . 0.0 110.857 -177.693 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.833 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 2.2 t80 -122.57 127.8 49.91 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.749 177.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.417 ' HE2' HG21 ' B' ' 41' ' ' THR . 11.2 mttt -123.29 124.57 43.27 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.191 -0.459 . . . . 0.0 109.876 176.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -88.11 128.34 35.42 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -179.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' MET . . . . . 0.479 ' HE3' HG23 ' B' ' 43' ' ' ILE . 0.0 OUTLIER -112.3 162.58 15.36 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 173.774 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . 0.45 ' O ' ' HB3' ' B' ' 70' ' ' LEU . 0.9 OUTLIER -79.17 140.77 37.66 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 179.799 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' ARG . . . . . 0.524 ' H ' ' HG3' ' B' ' 67' ' ' ARG . 0.0 OUTLIER -48.72 -48.42 40.44 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.628 -173.912 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . 0.495 ' HA3' ' S3 ' ' A' ' 138' ' ' PS5 . . . -104.05 -44.53 1.61 Allowed Glycine 0 N--CA 1.44 -1.04 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.021 176.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' LYS . . . . . 0.584 ' O ' ' HD2' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -82.45 35.73 0.46 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.327 -0.436 . . . . 0.0 111.669 -175.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' B' ' 66' ' ' SER . 0.1 OUTLIER -74.66 -25.26 59.07 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 173.519 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.457 ' CB ' ' HD3' ' B' ' 72' ' ' PRO . 0.0 OUTLIER -50.24 -59.47 7.06 Favored Pre-proline 0 CA--C 1.539 0.557 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.399 -179.607 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.594 ' HG3' ' HE2' ' A' ' 12' ' ' LYS . 3.9 Cg_exo -74.43 -15.85 22.04 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.605 2.203 . . . . 0.0 112.965 177.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . 0.421 HD22 ' HA ' ' B' ' 73' ' ' LEU . 0.2 OUTLIER -87.19 -6.22 58.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.607 0.242 . . . . 0.0 111.504 -174.767 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.598 HD23 ' CD1' ' A' ' 7' ' ' PHE . 6.0 tp -63.98 -54.87 27.6 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.555 -175.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.627 ' HB2' ' HB2' ' A' ' 8' ' ' ASP . . . -69.73 -23.62 63.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.891 0.377 . . . . 0.0 111.399 -179.439 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -74.91 -31.21 61.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.796 -177.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 20.0 m -73.93 -39.26 63.92 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.13 176.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.55 81.2 1.46 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.606 -0.807 . . . . 0.0 111.908 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.5 mt -123.45 142.54 50.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.657 0.265 . . . . 0.0 110.93 -178.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.514 ' OD2' ' HG2' ' B' ' 83' ' ' LYS . 0.0 OUTLIER -114.77 136.28 22.48 Favored Pre-proline 0 C--N 1.328 -0.362 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 178.24 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -64.49 -0.37 2.93 Favored 'Trans proline' 0 N--CA 1.476 0.468 0 C-N-CA 123.078 2.519 . . . . 0.0 114.234 -172.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.444 ' HB2' ' OD2' ' B' ' 80' ' ' ASP . 3.6 mm-40 -98.73 -11.59 21.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.766 0.317 . . . . 0.0 110.717 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.514 ' HG2' ' OD2' ' B' ' 80' ' ' ASP . 0.0 OUTLIER -82.85 122.01 77.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.626 179.028 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.547 ' O ' ' HA ' ' B' ' 40' ' ' ILE . 15.9 Cg_exo -63.94 132.7 35.6 Favored 'Trans proline' 0 N--CA 1.459 -0.513 0 C-N-CA 122.363 2.042 . . . . 0.0 110.168 173.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.516 ' O ' ' HA ' ' B' ' 110' ' ' ILE . 0.0 OUTLIER -131.58 143.01 41.71 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 120.893 0.378 . . . . 0.0 111.124 -173.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.538 ' HB ' ' HB2' ' B' ' 111' ' ' TYR . 0.7 OUTLIER -121.85 139.78 47.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.867 0 N-CA-C 108.814 -0.809 . . . . 0.0 108.814 175.508 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' B' ' 43' ' ' ILE . 1.3 m -102.8 126.46 57.02 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.074 0.464 . . . . 0.0 110.33 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.996 ' HB2' HD11 ' B' ' 42' ' ' LEU . 3.2 t80 -111.88 140.27 46.68 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.834 -0.621 . . . . 0.0 111.371 -174.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . 0.568 ' SG ' ' HG2' ' B' ' 46' ' ' ARG . 49.6 t 170.34 -63.92 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 115.222 -0.899 . . . . 0.0 108.866 176.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.557 ' HA ' ' HA2' ' B' ' 116' ' ' GLY . 0.1 OUTLIER -172.36 -167.76 0.49 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.261 -0.882 . . . . 0.0 109.173 175.708 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.62 -36.79 60.15 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -175.233 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.6 -167.44 0.68 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -168.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.665 ' HA ' ' HB3' ' B' ' 96' ' ' ALA . . . -56.95 -26.77 60.24 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 114.047 -1.433 . . . . 0.0 113.645 -172.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.39 -55.0 11.94 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.749 0.309 . . . . 0.0 111.365 -176.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -77.9 -33.94 51.69 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.947 177.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' ALA . . . . . 0.665 ' HB3' ' HA ' ' B' ' 93' ' ' ALA . . . -61.72 -32.36 72.58 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.111 -176.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' LEU . . . . . 0.453 HD21 HD21 ' A' ' 97' ' ' LEU . 0.7 OUTLIER -67.78 -39.59 84.05 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.799 0.333 . . . . 0.0 110.93 -178.461 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' ALA . . . . . . . . . . . . . . . -68.99 -45.57 70.26 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.0 0.429 . . . . 0.0 110.237 177.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -69.21 -50.47 33.17 Favored Glycine 0 N--CA 1.449 -0.489 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.54 -178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 100' ' ' LYS . . . . . 0.596 ' HG3' ' N ' ' B' ' 101' ' ' THR . 0.0 OUTLIER -60.96 -38.35 85.59 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.709 0.263 . . . . 0.0 111.709 -173.943 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . 0.596 ' N ' ' HG3' ' B' ' 100' ' ' LYS . 2.3 m -72.84 -35.91 67.35 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.614 0.245 . . . . 0.0 111.06 178.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 10.1 mt -62.94 -47.82 81.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.515 179.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.51 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -65.09 -26.75 68.36 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.906 0.384 . . . . 0.0 110.53 179.209 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -69.36 -7.45 37.55 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.828 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . 0.412 ' OH ' ' HA ' ' A' ' 11' ' ' PHE . 23.5 m-85 -103.36 -8.24 20.4 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.64 0.257 . . . . 0.0 110.938 178.281 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 108.14 41.4 1.53 Allowed Glycine 0 N--CA 1.448 -0.54 0 C-N-CA 120.243 -0.979 . . . . 0.0 112.735 175.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' PHE . . . . . . . . . . . . . 2.9 m-85 -87.05 149.25 24.86 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 176.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -87.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.418 -175.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -117.17 119.62 35.78 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.879 -177.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' ILE . . . . . 0.856 HG23 ' HG3' ' B' ' 22' ' ' MET . 1.2 tt -119.46 126.58 75.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 CA-C-O 121.252 0.549 . . . . 0.0 110.818 -176.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' TYR . . . . . 0.538 ' HB2' ' HB ' ' B' ' 86' ' ' VAL . 3.1 m-85 -112.95 141.67 46.52 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.866 -174.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.421 ' HB3' ' CE ' ' B' ' 24' ' ' MET . 0.7 OUTLIER -112.26 139.51 47.74 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 173.301 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . 0.516 ' HA ' ' O ' ' B' ' 25' ' ' LEU . 0.3 OUTLIER -81.93 119.86 24.48 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -173.266 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . 0.562 ' CG ' ' HB3' ' B' ' 24' ' ' MET . 2.4 mm-40 -82.08 5.19 20.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.79 177.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -107.99 -99.06 2.59 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.012 176.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . 0.557 ' HA2' ' HA ' ' B' ' 90' ' ' LYS . . . 155.18 166.74 15.82 Favored Glycine 0 N--CA 1.447 -0.616 0 N-CA-C 111.513 -0.635 . . . . 0.0 111.513 -178.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 117' ' ' MET . . . . . 0.469 ' HA ' ' CE2' ' B' ' 88' ' ' PHE . 0.1 OUTLIER -59.75 -39.19 83.96 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.006 0.431 . . . . 0.0 110.75 -178.208 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . 0.439 ' O ' ' HB2' ' B' ' 122' ' ' GLU . 18.6 p-10 -68.78 -23.85 64.35 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.83 178.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 119' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' B' ' 119' ' ' LYS . 0.1 OUTLIER -73.67 -32.14 63.82 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.883 177.441 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.683 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 27.7 t-105 -58.83 -51.46 69.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.736 177.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 11.5 mt -67.3 -40.12 86.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.144 178.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . 0.439 ' HB2' ' O ' ' B' ' 118' ' ' ASP . 0.2 OUTLIER -63.7 -45.93 87.79 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.665 -176.706 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . 0.854 ' HG2' ' HD3' ' B' ' 28' ' ' LYS . 0.0 OUTLIER -83.69 17.05 2.4 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.646 -176.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 67.44 23.05 73.46 Favored Glycine 0 C--N 1.331 0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 114.007 171.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.668 HD12 ' HA ' ' B' ' 120' ' ' TRP . 53.3 mt -75.29 154.54 86.15 Favored Pre-proline 0 C--N 1.323 -0.567 0 CA-C-N 117.101 0.451 . . . . 0.0 110.347 178.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -58.65 115.75 2.77 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.046 2.497 . . . . 0.0 112.219 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -133.17 150.59 52.0 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.181 -179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 128' ' ' LEU . . . . . 0.472 ' HB2' ' HG2' ' B' ' 56' ' ' LYS . 2.5 mt -83.31 101.07 11.05 Favored 'General case' 0 N--CA 1.445 -0.676 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 176.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -121.17 123.61 42.69 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 179.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -86.53 79.59 8.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.965 0.412 . . . . 0.0 110.707 -174.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -72.17 173.03 9.12 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.284 175.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 1.4 t-160 -80.27 54.1 1.92 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.234 0.54 . . . . 0.0 111.119 -178.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -94.93 126.55 40.34 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.293 -0.867 . . . . 0.0 108.939 174.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.23 103.12 0.45 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.924 -0.398 . . . . 0.0 109.924 -179.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -143.69 110.32 5.55 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.625 -173.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 8.3 t-80 -65.61 114.99 5.34 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.521 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 18.2 t-80 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.036 -0.983 . . . . 0.0 109.202 177.257 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' PS5 . . . . . 0.581 ' S1 ' ' HB3' ' A' ' 94' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 139' ' ' PS5 . . . . . 0.576 ' S4 ' ' HB2' ' A' ' 67' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.474 ' HA ' ' OD1' ' B' ' 80' ' ' ASP . . . . . . . . 0 N--CA 1.482 1.166 0 CA-C-O 120.718 0.294 . . . . 0.0 111.229 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.84 67.08 8.77 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.281 0.562 . . . . 0.0 111.352 -178.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.544 ' HG3' ' HG3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -113.88 10.07 17.63 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.331 178.72 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.549 ' HA2' ' CZ ' ' A' ' 7' ' ' PHE . . . -62.69 -39.8 98.38 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 121.04 -0.6 . . . . 0.0 112.783 -177.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.8 mp0 -65.03 -32.88 74.82 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.266 0.555 . . . . 0.0 110.289 176.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.544 ' HG3' ' HG3' ' A' ' 3' ' ' MET . 17.0 mmtt -64.78 -57.5 8.77 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.156 -0.929 . . . . 0.0 112.252 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.549 ' CZ ' ' HA2' ' A' ' 4' ' ' GLY . 2.8 p90 -80.43 -26.65 38.29 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 119.788 -0.765 . . . . 0.0 112.065 -174.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.449 ' HB2' ' CB ' ' B' ' 75' ' ' ALA . 16.0 t70 -53.85 -51.18 64.43 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 120.959 0.409 . . . . 0.0 111.176 -179.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.41 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.388 -179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 1.1 m -68.57 -40.62 80.48 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.932 -175.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.427 ' HZ ' ' HA ' ' B' ' 98' ' ' ALA . 0.5 OUTLIER -57.86 -45.96 85.54 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.194 0.521 . . . . 0.0 110.293 -178.402 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.56 ' HD3' ' HG3' ' B' ' 72' ' ' PRO . 1.2 tptp -65.31 -24.98 67.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.083 175.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -75.18 -44.54 46.05 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.227 178.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -71.51 -51.3 24.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.613 -177.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.763 HG13 ' HB2' ' A' ' 93' ' ' ALA . 2.3 t -57.24 -33.63 43.79 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-O 120.979 0.419 . . . . 0.0 110.869 -179.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.41 -37.4 70.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.356 177.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -63.35 -26.04 68.57 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.028 0.442 . . . . 0.0 111.551 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.04 -31.63 66.34 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.06 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.2 mtmt -76.14 -22.43 55.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.42 0.628 . . . . 0.0 110.579 173.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -75.26 -21.15 58.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.865 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -76.85 -9.12 58.46 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.886 -176.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -127.98 171.6 11.69 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.128 -0.357 . . . . 0.0 111.299 -177.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 39.0 t -84.49 109.66 18.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 172.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' MET . . . . . 0.721 ' SD ' ' HB3' ' A' ' 112' ' ' ASN . 0.6 OUTLIER -78.02 103.47 7.98 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.7 -174.739 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.596 ' O ' ' HA ' ' A' ' 113' ' ' SER . 7.5 mt -121.1 140.89 51.34 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.157 0.503 . . . . 0.0 111.316 -177.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.74 141.77 76.15 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.052 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -44.51 -30.12 3.7 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 124.203 3.269 . . . . 0.0 114.636 -176.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.457 ' HG2' ' OE2' ' A' ' 123' ' ' GLU . 0.4 OUTLIER -73.65 -42.59 61.2 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.941 0.4 . . . . 0.0 111.142 178.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.38 -33.25 69.35 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.212 177.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.428 ' O ' ' HG ' ' A' ' 34' ' ' LEU . . . -65.98 -47.46 74.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.082 176.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TYR . . . . . 0.617 ' HA ' HD12 ' A' ' 34' ' ' LEU . 51.6 t80 -64.2 -30.53 71.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.076 177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.36 -52.61 64.67 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.792 179.022 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.423 ' H ' ' HG ' ' A' ' 33' ' ' LEU . 0.2 OUTLIER -73.73 -27.42 61.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.613 -0.267 . . . . 0.0 110.886 178.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.617 HD12 ' HA ' ' A' ' 31' ' ' TYR . 35.2 mt -62.32 -54.65 37.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.302 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.448 ' HG3' ' N ' ' A' ' 36' ' ' GLU . 0.0 OUTLIER -76.39 -28.03 56.56 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.04 -174.348 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.448 ' N ' ' HG3' ' A' ' 35' ' ' GLN . 17.7 mt-10 -79.74 -34.13 40.23 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.222 0.534 . . . . 0.0 110.426 -177.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -117.53 94.58 45.92 Favored Pre-proline 0 C--N 1.321 -0.67 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.718 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -60.87 -2.83 2.36 Favored 'Trans proline' 0 N--CA 1.474 0.381 0 C-N-CA 123.201 2.6 . . . . 0.0 113.921 -174.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -96.98 -18.92 19.13 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 121.107 -0.237 . . . . 0.0 110.955 177.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.502 ' HA ' ' O ' ' A' ' 84' ' ' PRO . 23.5 mt -77.25 108.59 10.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 172.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.487 HG21 ' HE2' ' A' ' 63' ' ' LYS . 0.2 OUTLIER -100.33 145.2 28.44 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.515 -173.979 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.744 HD11 ' HB2' ' A' ' 88' ' ' PHE . 7.8 tp -103.85 129.2 51.29 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 174.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 1.3 mp -112.7 121.53 65.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 121.091 0.472 . . . . 0.0 109.876 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.822 ' HB3' ' HE1' ' A' ' 62' ' ' TYR . 0.3 OUTLIER -98.38 138.87 34.98 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.844 -179.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -123.97 95.33 3.26 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 CA-C-O 121.489 0.662 . . . . 0.0 109.462 174.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 1.107 ' HA ' HH21 ' A' ' 94' ' ' ARG . 1.8 tpt85 -152.24 163.85 38.57 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.274 -0.876 . . . . 0.0 108.774 -179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -87.49 139.92 31.81 Favored Pre-proline 0 C--N 1.322 -0.61 0 C-N-CA 120.558 -0.457 . . . . 0.0 110.15 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -62.09 -19.32 65.97 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.322 2.681 . . . . 0.0 115.059 -166.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.461 ' HB2' ' OE2' ' B' ' 50' ' ' GLU . 0.1 OUTLIER -76.7 -39.2 52.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.041 -0.664 . . . . 0.0 111.386 -178.927 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.19 -37.55 66.46 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 175.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.602 HD13 ' HB3' ' A' ' 46' ' ' ARG . 0.8 OUTLIER -59.34 -45.84 90.26 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.234 0.54 . . . . 0.0 110.912 177.327 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -35.52 80.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.85 -177.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -80.87 -48.52 12.26 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 112.573 0.582 . . . . 0.0 112.573 -175.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -92.62 -36.79 12.79 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.578 -0.449 . . . . 0.0 112.199 -173.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 126.3 173.19 13.51 Favored Glycine 0 N--CA 1.44 -1.097 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.819 179.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.566 ' HB2' ' HD2' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -149.04 165.7 17.09 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 108.817 -0.808 . . . . 0.0 108.817 -178.729 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.566 ' HD2' ' HB2' ' A' ' 56' ' ' LYS . 18.6 Cg_endo -63.78 123.63 12.3 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 121.881 1.72 . . . . 0.0 112.387 -178.393 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -94.16 71.97 3.93 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.072 0.463 . . . . 0.0 110.044 177.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 4.5 m -115.94 174.41 3.3 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.678 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.34 -24.27 32.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.812 0.339 . . . . 0.0 111.383 -176.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -125.43 66.45 1.15 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.384 0.612 . . . . 0.0 111.335 -175.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.822 ' HE1' ' HB3' ' A' ' 44' ' ' ASP . 0.8 OUTLIER -132.84 139.13 47.31 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.785 -0.643 . . . . 0.0 109.623 177.332 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.487 ' HE2' HG21 ' A' ' 41' ' ' THR . 0.0 OUTLIER -135.36 135.72 40.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.975 0.417 . . . . 0.0 110.533 176.399 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 14.0 t-160 -93.18 115.63 28.25 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.493 178.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.4 171.24 7.88 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 178.391 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.27 170.57 14.73 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.689 -0.486 . . . . 0.0 109.689 175.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.495 ' HB2' ' S4 ' ' B' ' 139' ' ' PS5 . 0.3 OUTLIER -94.23 -44.9 7.75 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 120.892 -0.323 . . . . 0.0 111.021 -175.858 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.423 ' HA3' ' HB2' ' B' ' 92' ' ' ALA . . . -102.43 -45.33 1.7 Allowed Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.81 -0.71 . . . . 0.0 111.499 175.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.436 ' O ' ' HD2' ' A' ' 72' ' ' PRO . 3.6 mttm -89.11 35.4 0.8 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.301 -0.45 . . . . 0.0 110.619 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.487 ' HG ' ' N ' ' A' ' 71' ' ' GLU . 0.2 OUTLIER -68.02 -35.09 77.72 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 176.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.962 ' HB3' ' HB3' ' B' ' 11' ' ' PHE . 0.0 OUTLIER -45.01 -57.62 6.85 Favored Pre-proline 0 CA--C 1.545 0.772 0 CA-C-N 115.039 -0.982 . . . . 0.0 112.757 -174.603 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.519 ' HD3' ' CD ' ' A' ' 71' ' ' GLU . 74.0 Cg_endo -73.65 -15.87 24.14 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.051 1.834 . . . . 0.0 112.605 178.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.467 ' HA ' HD22 ' A' ' 73' ' ' LEU . 0.1 OUTLIER -81.29 -22.32 38.68 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 177.283 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.685 HD21 HD21 ' A' ' 102' ' ' LEU . 3.7 tp -58.31 -53.16 61.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.538 -0.756 . . . . 0.0 110.137 177.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -66.01 -27.38 68.08 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.02 -0.991 . . . . 0.0 111.585 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.91 -22.54 39.64 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.755 0.312 . . . . 0.0 111.235 -179.011 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' SER . . . . . 0.465 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 49.8 m -79.57 -35.82 39.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.9 -177.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 94.18 63.39 1.04 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.521 -0.847 . . . . 0.0 111.869 -179.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 43.7 mt -110.45 136.67 49.23 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.574 0.226 . . . . 0.0 110.408 -179.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASP . . . . . 0.503 ' OD2' ' HG2' ' A' ' 83' ' ' LYS . 0.0 OUTLIER -121.52 138.81 28.81 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -179.238 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' B' ' 1' ' ' ALA . 31.9 Cg_endo -68.56 8.01 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 122.903 2.402 . . . . 0.0 113.719 -174.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -102.27 -17.44 15.91 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 122.106 -0.371 . . . . 0.0 110.616 176.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.503 ' HG2' ' OD2' ' A' ' 80' ' ' ASP . 0.0 OUTLIER -93.69 126.19 50.64 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.684 178.499 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.621 ' HB3' ' HB ' ' A' ' 109' ' ' THR . 18.1 Cg_exo -65.36 143.75 77.68 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.769 2.313 . . . . 0.0 111.362 177.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.509 HG23 HD12 ' A' ' 110' ' ' ILE . 2.4 m -137.72 149.65 25.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-O 121.076 0.465 . . . . 0.0 111.046 -178.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.564 ' HB ' ' HB2' ' A' ' 111' ' ' TYR . 0.7 OUTLIER -125.74 142.91 41.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 176.488 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.447 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 2.9 m -103.4 134.11 45.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.951 0.405 . . . . 0.0 110.608 -177.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' PHE . . . . . 0.744 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.0 OUTLIER -120.12 141.47 49.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.939 -176.207 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 46.8 t -173.39 -76.81 0.01 OUTLIER 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.887 177.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.85 ' HA ' ' HA3' ' A' ' 116' ' ' GLY . 0.0 OUTLIER -172.1 -175.44 1.45 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.443 177.332 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -73.94 65.53 1.08 Allowed 'General case' 0 C--N 1.326 -0.453 0 O-C-N 123.393 0.433 . . . . 0.0 111.209 179.239 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.644 ' HB1' ' HA3' ' B' ' 68' ' ' GLY . . . -153.03 176.5 11.82 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.162 0.506 . . . . 0.0 112.228 -173.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.763 ' HB2' HG13 ' A' ' 15' ' ' VAL . . . -74.28 -25.0 59.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.069 -178.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ARG . . . . . 1.107 HH21 ' HA ' ' A' ' 46' ' ' ARG . 1.7 ttt180 -43.77 -51.0 7.56 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 112.732 0.642 . . . . 0.0 112.732 -173.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.447 ' HB1' ' HB ' ' A' ' 87' ' ' VAL . . . -68.74 -31.3 70.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.971 0.415 . . . . 0.0 111.299 -178.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.93 -28.56 69.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.751 -0.659 . . . . 0.0 112.287 -178.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.74 -38.89 92.54 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.853 -0.339 . . . . 0.0 110.695 -179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -74.9 -46.76 33.82 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.693 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -65.46 -55.48 20.47 Favored Glycine 0 CA--C 1.519 0.299 0 C-N-CA 121.058 -0.591 . . . . 0.0 113.57 -176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.551 ' O ' ' HG3' ' A' ' 103' ' ' ARG . 0.0 OUTLIER -61.86 -32.86 73.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.813 0.34 . . . . 0.0 111.199 -174.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.479 ' N ' ' HG3' ' A' ' 100' ' ' LYS . 44.1 m -72.88 -38.74 66.88 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.782 0.325 . . . . 0.0 110.974 177.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.685 HD21 HD21 ' A' ' 74' ' ' LEU . 11.6 mt -64.3 -45.2 89.0 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.47 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ARG . . . . . 0.551 ' HG3' ' O ' ' A' ' 100' ' ' LYS . 0.0 OUTLIER -65.1 -27.47 68.77 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.919 0.39 . . . . 0.0 110.597 179.157 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.19 -6.73 41.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.368 178.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' TYR . . . . . 0.454 ' OH ' ' HA ' ' B' ' 11' ' ' PHE . 22.6 m-85 -104.21 -5.42 21.95 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 120.784 0.326 . . . . 0.0 110.543 176.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 107.07 34.61 2.93 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.952 173.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 3.1 m-85 -78.23 139.27 38.93 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.682 0.277 . . . . 0.0 110.44 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.39 -60.85 3.02 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.296 -0.865 . . . . 0.0 112.751 -172.248 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.621 ' HB ' ' HB3' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -139.23 120.01 14.28 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.294 -178.573 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.546 HG21 ' HB3' ' A' ' 103' ' ' ARG . 0.7 OUTLIER -121.37 127.16 75.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.23 0.538 . . . . 0.0 111.397 -176.712 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.564 ' HB2' ' HB ' ' A' ' 86' ' ' VAL . 1.9 m-85 -118.52 145.76 45.06 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.261 -176.118 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . 0.721 ' HB3' ' SD ' ' A' ' 24' ' ' MET . 38.4 t-20 -117.12 143.41 45.84 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.596 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 0.5 OUTLIER -97.23 115.46 27.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -172.851 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLU . . . . . 0.471 ' HG3' ' HB3' ' A' ' 24' ' ' MET . 2.9 mm-40 -76.32 33.96 0.13 Allowed 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.949 -179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -139.84 -78.44 0.06 OUTLIER Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.315 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . 0.85 ' HA3' ' HA ' ' A' ' 90' ' ' LYS . . . 114.02 178.8 19.14 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.626 -0.797 . . . . 0.0 112.548 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' MET . . . . . 0.432 ' SD ' ' HD3' ' A' ' 57' ' ' PRO . 10.4 tpp -53.61 -38.49 64.07 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.017 0.437 . . . . 0.0 111.178 -177.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -58.48 -41.66 85.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.573 178.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' LYS . . . . . 0.48 ' O ' ' HB2' ' A' ' 123' ' ' GLU . 0.0 OUTLIER -73.8 -32.66 63.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.355 179.598 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.612 ' HB2' ' CZ ' ' A' ' 88' ' ' PHE . 32.8 t-105 -61.11 -53.66 54.26 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 110.051 -0.351 . . . . 0.0 110.051 178.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 9.1 mt -63.68 -42.19 98.06 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.109 178.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -65.41 -41.49 93.53 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.804 -177.462 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . 0.564 ' HB3' ' HG ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -67.08 -21.2 65.89 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.913 0.387 . . . . 0.0 110.972 -177.343 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 90.5 21.87 36.14 Favored Glycine 0 N--CA 1.447 -0.577 0 C-N-CA 120.629 -0.796 . . . . 0.0 111.883 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.564 ' HG ' ' HB3' ' A' ' 123' ' ' GLU . 24.3 mt -75.97 159.53 80.54 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.881 -0.414 . . . . 0.0 109.881 177.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.493 ' HD2' ' HB3' ' A' ' 125' ' ' LEU . 14.4 Cg_endo -54.17 114.03 1.62 Allowed 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.973 2.449 . . . . 0.0 111.704 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -118.05 148.78 41.93 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 120.991 0.424 . . . . 0.0 110.698 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 2.5 mt -97.02 100.77 12.26 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 172.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.96 158.82 43.86 Favored 'General case' 0 C--N 1.312 -1.038 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -175.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.87 68.8 4.0 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.024 0.44 . . . . 0.0 111.039 -176.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.97 158.12 37.05 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.925 177.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -78.6 60.48 2.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.967 0.413 . . . . 0.0 111.814 -175.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -128.64 148.28 50.79 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 172.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -76.5 92.58 3.44 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.413 0.625 . . . . 0.0 110.909 -175.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 3.6 t60 -139.61 136.41 34.35 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.287 -178.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -136.99 164.74 27.63 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 . . . . . 0 C--O 1.246 0.887 0 CA-C-O 118.211 -0.9 . . . . 0.0 109.924 178.779 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . 0.509 ' O ' ' HD2' ' A' ' 81' ' ' PRO . . . . . . . . 0 N--CA 1.474 0.769 0 CA-C-O 120.91 0.386 . . . . 0.0 110.119 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -77.95 80.78 4.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.24 0.543 . . . . 0.0 110.138 -179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' MET . . . . . 0.437 ' HG2' ' HG3' ' B' ' 6' ' ' LYS . 14.1 mtp -101.75 33.04 3.14 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.283 -0.871 . . . . 0.0 111.374 -173.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' GLY . . . . . 0.596 ' HA2' ' CZ ' ' B' ' 7' ' ' PHE . . . -58.49 -35.03 78.04 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 121.319 -0.467 . . . . 0.0 113.434 -177.625 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -71.83 -31.88 66.98 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.012 0.434 . . . . 0.0 110.561 178.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LYS . . . . . 0.503 ' HD3' ' HA ' ' B' ' 6' ' ' LYS . 6.2 mmtt -71.31 -57.8 4.13 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.599 -0.728 . . . . 0.0 112.134 -173.229 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.596 ' CZ ' ' HA2' ' B' ' 4' ' ' GLY . 1.6 p90 -73.01 -35.59 66.84 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 119.787 -0.765 . . . . 0.0 112.103 -174.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -54.33 -56.08 22.1 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.83 0.348 . . . . 0.0 110.877 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.08 -46.55 85.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.801 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -65.53 -41.87 92.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.536 -177.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' PHE . . . . . 0.962 ' HB3' ' HB3' ' A' ' 71' ' ' GLU . 0.3 OUTLIER -54.11 -43.89 70.81 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.217 0.532 . . . . 0.0 110.525 -178.045 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' LYS . . . . . . . . . . . . . 5.6 tptm -65.24 -24.43 67.33 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.619 177.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.41 -49.78 21.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.899 0.38 . . . . 0.0 110.853 178.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' GLN . . . . . 0.405 ' OE1' HG23 ' A' ' 101' ' ' THR . 65.2 mt-30 -71.33 -52.0 21.16 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.896 -178.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.625 HG22 ' HB2' ' B' ' 93' ' ' ALA . 0.8 OUTLIER -56.29 -33.47 37.75 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.146 -177.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -70.94 -34.92 71.96 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.2 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.01 -26.74 68.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.934 0.397 . . . . 0.0 111.065 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.17 72.03 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.631 177.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' LYS . . . . . 0.532 ' HB3' ' SD ' ' B' ' 24' ' ' MET . 6.9 mtmt -76.07 -22.38 55.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.351 0.596 . . . . 0.0 111.008 174.554 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ALA . . . . . . . . . . . . . . . -73.28 -19.02 61.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.122 -177.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -80.62 -5.46 56.91 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.527 -177.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' MET . . . . . 0.924 ' HG3' HG23 ' B' ' 110' ' ' ILE . 1.5 mpp? -122.16 176.33 5.89 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.567 0.222 . . . . 0.0 110.79 -179.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 31.5 t -88.37 105.03 15.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' MET . . . . . 0.532 ' SD ' ' HB3' ' B' ' 19' ' ' LYS . 0.5 OUTLIER -75.68 111.28 10.85 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.998 0.428 . . . . 0.0 110.767 -175.223 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' B' ' 25' ' ' LEU . 5.2 mt -124.17 144.29 50.0 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.081 -176.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -80.15 146.04 61.97 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.402 -0.817 . . . . 0.0 109.547 176.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_endo -51.52 -21.56 10.84 Favored 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 123.522 2.815 . . . . 0.0 114.104 -175.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -75.03 -47.45 28.95 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.053 0.454 . . . . 0.0 110.821 175.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -69.02 -32.63 72.29 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.676 178.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.82 -47.79 61.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.498 -0.773 . . . . 0.0 110.967 178.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' TYR . . . . . 0.512 ' HA ' ' HB2' ' B' ' 34' ' ' LEU . 86.2 t80 -67.02 -29.73 69.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.748 178.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.96 -53.51 57.4 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.82 178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.41 ' H ' ' HG ' ' B' ' 33' ' ' LEU . 0.2 OUTLIER -74.08 -27.59 60.97 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.01 178.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.607 HD11 ' HB2' ' B' ' 42' ' ' LEU . 0.2 OUTLIER -62.53 -45.84 91.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.136 178.454 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -75.87 -26.99 57.57 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.487 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -84.16 -29.43 26.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.813 0.339 . . . . 0.0 110.771 -177.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -125.68 98.73 33.77 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.268 -178.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.64 2.74 1.8 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 123.13 2.554 . . . . 0.0 112.871 -179.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -90.33 -20.77 22.51 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 176.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ILE . . . . . 0.582 HG12 ' HB2' ' B' ' 84' ' ' PRO . 41.1 mt -80.22 112.52 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 CA-C-N 115.278 -0.874 . . . . 0.0 110.123 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' THR . . . . . 0.561 ' HB ' HG12 ' B' ' 85' ' ' VAL . 1.9 m -94.72 140.64 29.62 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.057 -178.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.845 HD11 ' HB2' ' B' ' 88' ' ' PHE . 8.0 tp -105.12 123.82 48.48 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 172.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' ILE . . . . . 0.417 ' HA ' ' O ' ' B' ' 63' ' ' LYS . 2.1 mp -110.29 115.53 49.97 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.573 177.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ASP . . . . . 0.809 ' HB3' ' HE1' ' B' ' 62' ' ' TYR . 0.3 OUTLIER -99.06 140.51 33.11 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.553 -179.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -128.87 94.7 2.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.655 0.741 . . . . 0.0 109.84 174.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . 0.712 ' HG2' HH21 ' B' ' 94' ' ' ARG . 21.0 mtp85 -145.44 164.18 32.36 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.11 -0.95 . . . . 0.0 109.362 178.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.493 ' OD1' ' HD3' ' B' ' 67' ' ' ARG . 5.7 m-20 -73.28 134.25 80.27 Favored Pre-proline 0 C--N 1.319 -0.748 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.242 -173.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_endo -65.05 -21.39 63.37 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.449 2.766 . . . . 0.0 114.621 -169.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.35 -31.31 48.5 Favored 'General case' 0 C--N 1.322 -0.601 0 C-N-CA 120.251 -0.579 . . . . 0.0 110.268 177.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' GLU . . . . . 0.461 ' OE2' ' HB2' ' A' ' 49' ' ' ASP . 2.3 mm-40 -70.91 -40.88 71.88 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.046 173.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.778 HD23 ' HD3' ' B' ' 56' ' ' LYS . 0.5 OUTLIER -60.2 -33.57 72.42 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.605 176.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 -39.12 54.07 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.512 -179.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.47 -46.83 13.98 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' MET . . . . . . . . . . . . . 4.1 mtm -97.65 -35.06 10.71 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.716 -0.393 . . . . 0.0 111.5 -174.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' GLY . . . . . . . . . . . . . . . 122.42 173.17 14.2 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.262 179.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' LYS . . . . . 0.778 ' HD3' HD23 ' B' ' 51' ' ' LEU . 0.0 OUTLIER -138.82 156.73 72.65 Favored Pre-proline 0 C--N 1.324 -0.512 0 N-CA-C 109.627 -0.508 . . . . 0.0 109.627 178.401 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' PRO . . . . . 0.487 ' HB3' ' CE2' ' B' ' 120' ' ' TRP . 16.4 Cg_endo -60.8 125.21 16.64 Favored 'Trans proline' 0 C--N 1.343 0.265 0 C-N-CA 122.647 2.231 . . . . 0.0 112.956 -177.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . 0.791 ' HB2' ' HG ' ' B' ' 128' ' ' LEU . 17.7 t0 -97.5 96.3 8.23 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.236 176.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' VAL . . . . . 0.684 HG22 ' HB2' ' B' ' 62' ' ' TYR . 34.9 m -130.89 164.65 33.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.302 176.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.26 -38.95 77.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.564 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -124.6 75.89 1.45 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.14 0.495 . . . . 0.0 110.851 -177.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' TYR . . . . . 0.809 ' HE1' ' HB3' ' B' ' 44' ' ' ASP . 13.5 t80 -118.08 126.02 51.43 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.451 -178.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.417 ' O ' ' HA ' ' B' ' 43' ' ' ILE . 15.4 mttm -128.04 120.48 27.58 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.964 0.412 . . . . 0.0 110.346 178.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' HIS . . . . . 0.481 ' HD2' ' O ' ' B' ' 44' ' ' ASP . 11.5 t-160 -95.83 114.2 25.9 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.021 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' MET . . . . . 0.443 ' SD ' ' HA ' ' B' ' 74' ' ' LEU . 0.0 OUTLIER -96.22 170.73 9.05 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 177.887 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . 0.504 ' HB3' ' S5 ' ' A' ' 138' ' ' PS5 . 0.3 OUTLIER -70.87 141.87 51.22 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 172.134 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' ARG . . . . . 0.493 ' HD3' ' OD1' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -63.43 -40.71 97.89 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.022 0.439 . . . . 0.0 111.697 -172.13 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' GLY . . . . . 0.644 ' HA3' ' HB1' ' A' ' 92' ' ' ALA . . . -103.34 -45.66 1.54 Allowed Glycine 0 N--CA 1.44 -1.05 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.435 176.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.47 39.27 0.72 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.333 -0.433 . . . . 0.0 110.776 -179.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' LEU . . . . . 0.53 ' HG ' ' N ' ' B' ' 71' ' ' GLU . 0.1 OUTLIER -73.74 -31.92 63.6 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 175.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' GLU . . . . . 0.53 ' N ' ' HG ' ' B' ' 70' ' ' LEU . 0.0 OUTLIER -47.3 -60.32 4.21 Favored Pre-proline 0 CA--C 1.542 0.665 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.295 -175.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' PRO . . . . . 0.56 ' HG3' ' HD3' ' A' ' 12' ' ' LYS . 3.5 Cg_exo -74.66 -16.36 21.16 Favored 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 122.692 2.261 . . . . 0.0 112.916 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -91.11 -21.74 21.05 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.678 0.275 . . . . 0.0 111.458 -174.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' LEU . . . . . 0.711 HD21 HD21 ' B' ' 102' ' ' LEU . 3.4 tp -61.02 -51.27 69.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.607 -173.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.449 ' CB ' ' HB2' ' A' ' 8' ' ' ASP . . . -74.1 -17.49 60.93 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -175.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -76.15 -24.7 54.84 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 120.937 0.399 . . . . 0.0 110.922 -176.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.64 -28.0 51.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.8 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.67 83.41 1.56 Allowed Glycine 0 N--CA 1.445 -0.724 0 C-N-CA 120.278 -0.963 . . . . 0.0 112.303 -179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.0 mt -126.0 144.68 50.61 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 110.199 -0.296 . . . . 0.0 110.199 179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' ASP . . . . . 0.474 ' OD1' ' HA ' ' A' ' 1' ' ' ALA . 16.2 t70 -114.11 130.51 23.85 Favored Pre-proline 0 C--N 1.326 -0.454 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 179.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' PRO . . . . . 0.651 ' O ' ' HA ' ' B' ' 107' ' ' PHE . 33.8 Cg_endo -68.47 -6.81 18.55 Favored 'Trans proline' 0 N--CA 1.472 0.255 0 C-N-CA 122.921 2.414 . . . . 0.0 113.912 -175.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 33.5 mm-40 -98.95 2.58 46.57 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.538 -0.465 . . . . 0.0 110.42 177.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' LYS . . . . . 0.41 ' HA ' ' HD3' ' B' ' 83' ' ' LYS . 33.3 mmtm -106.76 142.66 25.44 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.132 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' PRO . . . . . 0.582 ' HB2' HG12 ' B' ' 40' ' ' ILE . 16.9 Cg_exo -69.35 134.71 29.53 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.545 2.163 . . . . 0.0 111.859 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.561 HG12 ' HB ' ' B' ' 41' ' ' THR . 5.6 m -135.65 147.91 28.44 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.39 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.557 HG13 HD12 ' B' ' 42' ' ' LEU . 0.5 OUTLIER -126.5 141.42 46.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.784 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 3.3 m -103.28 122.1 55.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.057 0.456 . . . . 0.0 110.062 179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' PHE . . . . . 0.845 ' HB2' HD11 ' B' ' 42' ' ' LEU . 7.3 t80 -110.28 143.87 39.83 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.702 -175.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' CYS . . . . . . . . . . . . . 53.4 t 178.78 -67.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.92 177.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.719 ' HA ' ' HA2' ' B' ' 116' ' ' GLY . 0.0 OUTLIER -176.9 -173.79 0.5 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.197 179.533 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -80.16 61.86 4.13 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 120.838 0.352 . . . . 0.0 110.269 175.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' ALA . . . . . 0.423 ' HB2' ' HA3' ' A' ' 68' ' ' GLY . . . -137.89 167.17 22.31 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.23 0.538 . . . . 0.0 112.136 -172.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' ALA . . . . . 0.625 ' HB2' HG22 ' B' ' 15' ' ' VAL . . . -69.48 -26.02 64.36 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.079 177.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' ARG . . . . . 0.712 HH21 ' HG2' ' B' ' 46' ' ' ARG . 0.8 OUTLIER -47.85 -49.8 28.22 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.693 -178.213 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.14 -36.2 66.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.932 0.396 . . . . 0.0 110.812 179.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' ALA . . . . . 0.408 ' N ' HD21 ' B' ' 112' ' ' ASN . . . -60.97 -28.99 69.4 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.513 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.06 -40.4 90.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.965 0.412 . . . . 0.0 110.502 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' ALA . . . . . 0.427 ' HA ' ' HZ ' ' A' ' 11' ' ' PHE . . . -70.37 -40.42 74.03 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.72 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 99' ' ' GLY . . . . . 0.448 ' HA2' HD11 ' B' ' 110' ' ' ILE . . . -76.92 -49.87 7.36 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.799 -0.715 . . . . 0.0 113.615 -176.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 100' ' ' LYS . . . . . 0.601 ' O ' ' HG3' ' B' ' 103' ' ' ARG . 0.0 OUTLIER -64.79 -30.14 71.14 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.558 -0.378 . . . . 0.0 111.873 -172.238 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 101' ' ' THR . . . . . . . . . . . . . 3.2 m -72.03 -35.9 69.52 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.12 0.486 . . . . 0.0 110.163 175.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 102' ' ' LEU . . . . . 0.711 HD21 HD21 ' B' ' 74' ' ' LEU . 9.2 mt -67.1 -42.69 84.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.736 -179.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 103' ' ' ARG . . . . . 0.601 ' HG3' ' O ' ' B' ' 100' ' ' LYS . 0.0 OUTLIER -62.25 -27.28 68.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.986 0.422 . . . . 0.0 110.497 179.799 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 104' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -71.42 -6.75 42.58 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.736 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 105' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -104.38 -7.99 19.51 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.836 0.351 . . . . 0.0 110.634 178.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' GLY . . . . . . . . . . . . . . . 111.52 15.28 10.49 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.655 175.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' PHE . . . . . 0.651 ' HA ' ' O ' ' B' ' 81' ' ' PRO . 6.7 m-85 -61.88 125.79 25.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.793 0.33 . . . . 0.0 110.495 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.13 -76.05 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.077 -172.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' THR . . . . . 0.553 ' HB ' ' HB3' ' B' ' 84' ' ' PRO . 0.2 OUTLIER -117.33 104.4 11.1 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.523 -174.172 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' ILE . . . . . 0.924 HG23 ' HG3' ' B' ' 22' ' ' MET . 1.5 tt -114.97 125.75 72.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.164 0.507 . . . . 0.0 110.967 -176.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' TYR . . . . . 0.465 ' CD1' ' HB ' ' B' ' 86' ' ' VAL . 1.1 m-85 -115.3 143.79 44.73 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.776 -175.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' ASN . . . . . 0.408 HD21 ' N ' ' B' ' 96' ' ' ALA . 0.7 OUTLIER -114.28 143.34 45.02 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 175.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' SER . . . . . . . . . . . . . 88.7 p -79.74 129.09 34.18 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.839 0.352 . . . . 0.0 111.53 -172.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -97.61 8.18 45.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.082 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 115' ' ' GLY . . . . . . . . . . . . . . . -122.3 -96.16 1.33 Allowed Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.756 -0.735 . . . . 0.0 111.741 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 116' ' ' GLY . . . . . 0.719 ' HA2' ' HA ' ' B' ' 90' ' ' LYS . . . 156.64 172.81 24.37 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.007 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 117' ' ' MET . . . . . 0.654 ' SD ' ' HD3' ' B' ' 46' ' ' ARG . 36.1 ttm -62.25 -35.38 78.77 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.08 0.467 . . . . 0.0 110.22 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 118' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.11 -33.56 74.67 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.194 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 119' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.01 -33.81 66.0 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.035 177.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 120' ' ' TRP . . . . . 0.65 ' HB2' ' CZ ' ' B' ' 88' ' ' PHE . 31.6 t-105 -58.68 -51.9 67.97 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 121' ' ' LEU . . . . . . . . . . . . . 18.7 mt -62.93 -40.01 96.32 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.992 177.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.71 -43.33 80.3 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.992 -0.549 . . . . 0.0 112.335 -175.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 123' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -73.4 0.87 10.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.663 0.268 . . . . 0.0 111.244 -176.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 76.74 24.43 67.29 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.043 -0.598 . . . . 0.0 112.337 176.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 125' ' ' LEU . . . . . 0.524 ' HB3' ' HD2' ' B' ' 126' ' ' PRO . 77.6 mt -77.39 161.29 73.06 Favored Pre-proline 0 C--N 1.322 -0.597 0 N-CA-C 110.278 -0.267 . . . . 0.0 110.278 178.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 126' ' ' PRO . . . . . 0.524 ' HD2' ' HB3' ' B' ' 125' ' ' LEU . 38.2 Cg_endo -66.86 129.86 21.82 Favored 'Trans proline' 0 C--O 1.234 0.318 0 C-N-CA 122.781 2.321 . . . . 0.0 112.29 -176.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 127' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -132.74 148.73 52.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.814 0.34 . . . . 0.0 110.773 -177.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 128' ' ' LEU . . . . . 0.791 ' HG ' ' HB2' ' B' ' 58' ' ' ASP . 6.7 mt -95.69 105.98 18.04 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 175.478 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -136.14 158.38 44.56 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.806 -178.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 130' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -81.18 70.73 8.09 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.026 0.441 . . . . 0.0 110.109 -179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.59 156.27 33.25 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.281 -176.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 132' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.65 25.17 0.26 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.62 -178.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 133' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -77.75 -17.42 57.58 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.722 -0.217 . . . . 0.0 110.829 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 134' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 65.75 70.61 0.44 Allowed 'General case' 0 C--O 1.234 0.242 0 O-C-N 123.731 0.645 . . . . 0.0 110.475 -178.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 135' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -118.48 108.48 15.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.651 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 136' ' ' HIS . . . . . . . . . . . . . 35.2 p-80 -69.1 134.22 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.193 0.521 . . . . 0.0 111.007 -176.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 137' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.207 -0.901 . . . . 0.0 109.824 -179.167 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' PS5 . . . . . 0.504 ' S5 ' ' HB3' ' B' ' 66' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 139' ' ' PS5 . . . . . 0.495 ' S4 ' ' HB2' ' A' ' 67' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_