data_1i8h_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 1i8h _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 5' ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.499 1.985 0 CA-C-O 121.971 0.891 . . . . 0.0 109.081 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 122.598 1.19 . . . . 0.0 113.555 -172.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.294 9.7 Cg_endo . . . . . 0 CA--C 1.578 2.694 0 N-CA-C 117.89 2.227 . . . . 0.0 117.89 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -83.06 -117.62 0.01 OUTLIER 'Trans proline' 0 CA--C 1.582 2.915 0 CA-C-N 123.987 2.46 . . . . 0.0 111.885 162.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.4 pttp . . . . . 0 CA--C 1.576 1.95 0 O-C-N 120.202 -1.561 . . . . 0.0 111.244 164.876 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 CA--C 1.581 2.162 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pp -74.71 171.66 10.94 Favored Pre-proline 0 CA--C 1.589 2.477 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -72.79 156.27 53.11 Favored 'Trans proline' 0 CA--C 1.586 3.107 0 N-CA-C 121.958 3.792 . . . . 0.0 121.958 -174.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.28 129.26 15.72 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 C-N-CA 123.029 2.486 . . . . 0.0 113.605 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.95 28.82 24.87 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 118.578 2.191 . . . . 0.0 118.578 -167.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.251 16.5 m95 -109.76 177.09 4.83 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 120.241 2.021 . . . . 0.0 116.352 173.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -148.56 162.36 39.81 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-O 124.122 1.915 . . . . 0.0 111.081 147.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.254 0.1 OUTLIER -101.14 116.75 33.54 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.541 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -101.05 160.23 14.55 Favored 'General case' 0 CA--C 1.557 1.224 0 O-C-N 120.093 -1.63 . . . . 0.0 107.98 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.18 125.04 13.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -173.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.292 20.7 p 74.99 146.63 0.09 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 119.047 2.98 . . . . 0.0 119.047 157.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 39.8 mtm-85 -130.0 -68.64 0.7 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.91 -1.119 . . . . 0.0 110.11 162.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 96.2 p -115.68 -70.65 0.78 Allowed 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 119.194 0.907 . . . . 0.0 111.941 170.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 34.0 t -72.18 1.98 6.66 Favored 'General case' 0 CA--C 1.579 2.096 0 N-CA-C 119.227 3.047 . . . . 0.0 119.227 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.66 54.61 1.91 Allowed Glycine 0 N--CA 1.489 2.169 0 CA-C-N 120.704 1.593 . . . . 0.0 113.628 -177.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -136.29 137.77 41.05 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 123.207 1.479 . . . . 0.0 113.676 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.802 1.1 p 135.1 148.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 C-N-CA 129.239 3.016 . . . . 0.0 111.642 177.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.345 52.4 m-85 -135.95 -48.2 0.67 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -159.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -155.38 146.82 22.91 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 123.11 1.433 . . . . 0.0 113.615 -160.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -151.42 122.53 7.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.512 -1.367 . . . . 0.0 108.55 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.35 124.24 27.6 Favored 'General case' 0 CA--C 1.57 1.744 0 O-C-N 119.736 -1.852 . . . . 0.0 110.833 174.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.33 -46.82 11.37 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -175.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.5 pt -61.82 -45.09 99.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.281 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 172.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 55.3 m -66.58 -48.11 70.63 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 165.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.343 53.4 m-80 77.97 68.41 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.673 0 C-N-CA 126.499 1.92 . . . . 0.0 112.656 -166.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -137.71 124.5 21.16 Favored 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.777 0.831 . . . . 0.0 110.739 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 37.4 m -83.39 142.26 31.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.377 -0.827 . . . . 0.0 112.892 172.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.27 10.1 pt20 -148.17 173.42 12.99 Favored 'General case' 0 CA--C 1.562 1.426 0 CA-C-O 123.58 1.657 . . . . 0.0 113.305 166.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.305 0.1 OUTLIER -111.33 39.69 2.25 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 169.297 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.11 160.1 40.71 Favored 'General case' 0 CA--C 1.563 1.472 0 CA-C-O 123.728 1.727 . . . . 0.0 111.228 174.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.25 15.2 ttt85 -54.2 157.49 4.56 Favored Pre-proline 0 CA--C 1.585 2.314 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 159.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -60.52 17.9 0.04 OUTLIER 'Trans proline' 0 CA--C 1.584 3.02 0 N-CA-C 119.173 2.72 . . . . 0.0 119.173 164.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.322 8.4 t . . . . . 0 N--CA 1.492 1.674 0 C-N-CA 125.538 1.535 . . . . 0.0 114.253 -172.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.302 3.4 t . . . . . 0 N--CA 1.503 2.199 0 CA-C-O 122.147 0.975 . . . . 0.0 109.797 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 35.0 ttp85 . . . . . 0 N--CA 1.496 1.835 0 O-C-N 120.969 -1.082 . . . . 0.0 113.471 -168.631 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.282 13.4 Cg_endo . . . . . 0 CA--C 1.585 3.052 0 N-CA-C 116.805 1.81 . . . . 0.0 116.805 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -80.06 -111.37 0.01 OUTLIER 'Trans proline' 0 CA--C 1.578 2.704 0 CA-C-N 125.018 2.828 . . . . 0.0 112.942 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.0 pttt . . . . . 0 CA--C 1.573 1.841 0 O-C-N 120.546 -1.347 . . . . 0.0 112.194 167.732 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.584 2.255 0 N-CA-C 118.071 2.619 . . . . 0.0 118.071 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.372 0.6 OUTLIER 50.41 163.62 0.04 OUTLIER Pre-proline 0 CA--C 1.59 2.481 0 N-CA-C 118.205 2.668 . . . . 0.0 118.205 -157.313 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -77.72 156.02 31.34 Favored 'Trans proline' 0 CA--C 1.591 3.366 0 N-CA-C 121.927 3.78 . . . . 0.0 121.927 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.34 130.54 15.23 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.135 2.556 . . . . 0.0 112.648 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.72 25.74 17.04 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 118.017 1.967 . . . . 0.0 118.017 -161.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.276 26.5 m95 -117.61 171.46 8.01 Favored 'General case' 0 CA--C 1.561 1.398 0 CA-C-N 120.387 2.094 . . . . 0.0 115.856 172.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -157.55 137.18 12.16 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 122.454 1.121 . . . . 0.0 113.187 147.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.67 127.53 32.76 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 174.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . 0.426 HH11 ' HG2' ' B' ' 9' ' ' ARG . 14.8 mtt-85 -137.07 111.62 8.65 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.996 -1.69 . . . . 0.0 110.737 -167.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 28.7 mtp -114.6 141.76 47.34 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 116.906 2.188 . . . . 0.0 116.906 -138.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.266 54.3 p 60.68 64.99 1.09 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 137.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 62.1 mtm180 -88.63 -12.18 43.25 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 68.9 m -144.64 -112.29 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.483 -1.386 . . . . 0.0 108.255 166.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 48.2 m -86.48 56.56 4.05 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 121.45 1.932 . . . . 0.0 115.176 -175.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.5 53.3 6.07 Favored Glycine 0 N--CA 1.489 2.174 0 O-C-N 120.514 -1.366 . . . . 0.0 114.719 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -132.8 144.47 50.26 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 122.259 1.028 . . . . 0.0 112.191 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.678 0.5 OUTLIER 73.27 135.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -159.113 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.351 1.9 p90 -175.02 7.07 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.311 0 C-N-CA 126.281 1.833 . . . . 0.0 114.905 -169.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -146.49 148.11 31.89 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 122.42 2.373 . . . . 0.0 112.76 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -150.58 123.37 8.64 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.112 -1.617 . . . . 0.0 108.199 173.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.28 126.1 33.43 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 119.959 -1.713 . . . . 0.0 110.641 172.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -88.17 -46.68 9.06 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.297 1.962 . . . . 0.0 116.297 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 33.5 pt -58.93 -40.26 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 56.4 m -71.55 -45.48 62.21 Favored 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 160.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.327 6.2 t30 79.04 67.91 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 125.838 1.655 . . . . 0.0 112.366 -169.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -142.38 122.65 13.88 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.391 0.676 . . . . 0.0 111.641 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 79.4 p -81.04 134.15 35.62 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -153.4 167.6 28.87 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.259 0.2 OUTLIER -113.3 36.92 3.35 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-N 113.622 -1.626 . . . . 0.0 114.986 169.937 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -148.14 157.4 43.48 Favored 'General case' 0 CA--C 1.571 1.767 0 CA-C-O 125.588 2.613 . . . . 0.0 111.408 167.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.341 18.7 ttp-105 -69.05 150.98 97.41 Favored Pre-proline 0 CA--C 1.58 2.13 0 CA-C-N 112.09 -2.323 . . . . 0.0 115.655 174.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.34 -35.92 98.89 Favored 'Trans proline' 0 CA--C 1.57 2.278 0 C-N-CA 122.614 2.209 . . . . 0.0 117.083 168.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.314 1.6 t . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 165.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.9 t . . . . . 0 N--CA 1.505 2.276 0 CA-C-O 125.401 2.524 . . . . 0.0 111.355 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.575 1.926 0 CA-C-N 111.276 -2.693 . . . . 0.0 115.354 -172.105 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.31 36.9 Cg_endo . . . . . 0 CA--C 1.586 3.094 0 CA-C-O 114.292 -2.462 . . . . 0.0 114.952 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -77.48 81.17 2.72 Favored 'Trans proline' 0 CA--C 1.57 2.312 0 CA-C-N 127.969 3.882 . . . . 0.0 112.809 173.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.57 1.728 0 N-CA-C 120.482 3.512 . . . . 0.0 120.482 -144.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 55.2 pttt . . . . . 0 CA--C 1.573 1.843 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 pp -115.35 175.59 1.84 Allowed Pre-proline 0 CA--C 1.588 2.409 0 CA-C-O 118.513 -0.756 . . . . 0.0 112.167 159.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -80.0 158.57 23.95 Favored 'Trans proline' 0 CA--C 1.59 3.299 0 N-CA-C 122.218 3.892 . . . . 0.0 122.218 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -78.47 129.87 9.62 Favored 'Trans proline' 0 CA--C 1.564 2.017 0 C-N-CA 123.233 2.622 . . . . 0.0 112.735 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.22 25.96 20.05 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 117.975 1.95 . . . . 0.0 117.975 -162.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.273 26.0 m95 -113.82 164.4 13.8 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-N 119.804 1.802 . . . . 0.0 114.662 172.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -145.17 -154.58 0.55 Allowed 'General case' 0 CA--C 1.569 1.708 0 CA-C-O 122.397 1.094 . . . . 0.0 112.219 147.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -145.28 119.61 9.59 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.816 -1.177 . . . . 0.0 111.293 -160.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -139.76 115.38 10.05 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.263 -1.523 . . . . 0.0 111.486 -161.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 26.8 mtp -114.32 142.07 46.79 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 117.985 2.587 . . . . 0.0 117.985 -139.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.323 55.9 p 71.59 75.83 0.17 Allowed 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 117.56 2.429 . . . . 0.0 117.56 151.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 24.8 mtp180 -102.48 -13.44 17.23 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 164.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 72.1 m -144.23 -157.03 0.75 Allowed 'General case' 0 CA--C 1.581 2.16 0 O-C-N 119.957 -1.715 . . . . 0.0 109.643 163.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 74.3 p -71.37 88.53 0.88 Allowed 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.328 -2.107 . . . . 0.0 115.105 -174.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.23 46.0 45.29 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 116.122 1.209 . . . . 0.0 116.122 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -134.2 122.74 23.22 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 117.975 0.887 . . . . 0.0 110.414 -163.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.783 0.3 OUTLIER 85.84 129.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 C-N-CA 124.712 1.205 . . . . 0.0 112.892 -168.204 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -177.09 5.69 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.976 0 C-N-CA 126.508 1.923 . . . . 0.0 115.607 -162.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -146.51 142.53 28.15 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 123.303 2.774 . . . . 0.0 112.3 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -147.47 127.82 13.96 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.324 1.049 . . . . 0.0 110.558 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.54 122.49 37.18 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 120.118 -1.614 . . . . 0.0 111.213 172.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -76.36 -53.25 8.45 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 178.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -65.27 -45.9 92.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 89.6 m -61.5 -45.17 95.35 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.288 13.3 t30 82.76 65.55 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 125.706 1.602 . . . . 0.0 112.269 -170.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -143.73 112.41 6.54 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.601 0.715 . . . . 0.0 112.217 -173.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 76.1 p -80.88 134.88 35.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.99 -1.069 . . . . 0.0 113.591 163.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -161.56 157.97 25.61 Favored 'General case' 0 CA--C 1.564 1.5 0 CA-C-O 123.342 1.544 . . . . 0.0 113.867 -171.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.283 0.5 OUTLIER -101.01 42.54 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.748 -1.114 . . . . 0.0 113.528 160.112 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -132.18 139.5 48.4 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.472 1.13 . . . . 0.0 111.712 -170.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 -90.04 130.28 42.98 Favored Pre-proline 0 CA--C 1.577 1.993 0 CA-C-O 118.021 -0.99 . . . . 0.0 113.164 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.19 -37.19 93.17 Favored 'Trans proline' 0 CA--C 1.574 2.506 0 C-N-CA 122.713 2.276 . . . . 0.0 116.532 172.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 117.845 2.535 . . . . 0.0 117.845 167.168 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.3 t . . . . . 0 CA--C 1.572 1.815 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.575 1.926 0 O-C-N 120.358 -1.463 . . . . 0.0 111.483 -159.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.382 18.1 Cg_endo . . . . . 0 CA--C 1.585 3.05 0 N-CA-C 118.523 2.471 . . . . 0.0 118.523 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.0 154.06 42.21 Favored 'Trans proline' 0 CA--C 1.569 2.264 0 CA-C-N 126.627 3.403 . . . . 0.0 113.442 167.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.562 -1.336 . . . . 0.0 114.206 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 49.7 tttm . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pp -147.44 164.94 20.39 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 174.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -82.06 158.93 18.08 Favored 'Trans proline' 0 CA--C 1.587 3.127 0 N-CA-C 121.963 3.794 . . . . 0.0 121.963 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.07 113.56 2.74 Favored 'Trans proline' 0 CA--C 1.564 2.019 0 C-N-CA 123.357 2.704 . . . . 0.0 112.611 -175.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 24.16 5.66 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -163.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.281 24.1 m95 -115.36 162.59 16.91 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.559 1.68 . . . . 0.0 114.21 175.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 -151.01 0.35 Allowed 'General case' 0 CA--C 1.573 1.861 0 CA-C-O 121.838 0.828 . . . . 0.0 112.09 150.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.77 118.18 7.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.637 -1.29 . . . . 0.0 111.759 -160.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.7 mtt-85 -137.32 113.94 10.32 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 119.992 -1.692 . . . . 0.0 112.923 -159.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -120.47 121.0 37.51 Favored 'General case' 0 CA--C 1.563 1.463 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -130.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.279 5.4 t 71.05 132.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 118.741 2.867 . . . . 0.0 118.741 163.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -124.87 -56.21 1.58 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.297 -1.502 . . . . 0.0 112.424 157.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 97.0 p -74.74 -43.04 57.02 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 58.1 m -158.47 -54.72 0.07 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.929 -1.107 . . . . 0.0 112.401 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -166.49 64.61 0.21 Allowed Glycine 0 N--CA 1.49 2.294 0 O-C-N 120.944 -1.097 . . . . 0.0 112.813 173.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -149.98 146.81 27.23 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.593 1.187 . . . . 0.0 112.636 -174.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.711 0.5 OUTLIER 79.73 130.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 120.882 -1.136 . . . . 0.0 112.641 -144.576 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.291 1.1 p90 -175.34 4.32 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.215 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -165.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -143.33 141.13 30.86 Favored 'General case' 0 N--CA 1.511 2.613 0 CA-C-N 122.772 2.533 . . . . 0.0 112.801 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -143.9 125.94 15.42 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.585 -1.322 . . . . 0.0 112.303 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.66 125.74 34.98 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.062 -1.649 . . . . 0.0 111.193 172.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -77.68 -50.93 11.45 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 175.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 24.4 mm -65.77 -46.38 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -62.54 -43.61 98.38 Favored 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 162.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.519 0.1 OUTLIER 75.79 74.85 0.09 Allowed 'General case' 0 CA--C 1.571 1.759 0 C-N-CA 125.656 1.583 . . . . 0.0 112.578 -163.588 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -141.43 109.59 5.85 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.017 -1.052 . . . . 0.0 111.263 -176.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p -82.23 126.25 31.88 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.541 -0.725 . . . . 0.0 112.822 166.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -146.32 170.14 17.39 Favored 'General case' 0 CA--C 1.565 1.524 0 CA-C-O 123.76 1.743 . . . . 0.0 114.913 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.31 1.9 p-90 -115.96 43.23 2.17 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 166.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.42 159.74 41.46 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 123.125 1.44 . . . . 0.0 110.516 162.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -90.48 142.71 28.38 Favored Pre-proline 0 CA--C 1.58 2.125 0 CA-C-N 114.829 -1.078 . . . . 0.0 112.469 166.387 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -60.15 -2.0 1.56 Allowed 'Trans proline' 0 CA--C 1.582 2.906 0 C-N-CA 123.589 2.859 . . . . 0.0 119.141 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.317 7.1 t . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -177.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.0 t . . . . . 0 N--CA 1.505 2.325 0 CA-C-O 121.961 0.886 . . . . 0.0 112.64 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.573 1.836 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -166.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.336 30.6 Cg_endo . . . . . 0 CA--C 1.586 3.087 0 N-CA-C 118.702 2.539 . . . . 0.0 118.702 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -66.52 142.32 64.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 CA-C-N 126.854 3.484 . . . . 0.0 115.149 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -157.461 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 tptp . . . . . 0 N--CA 1.495 1.82 0 N-CA-C 111.025 0.009 . . . . 0.0 111.025 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.7 174.55 2.55 Favored Pre-proline 0 CA--C 1.589 2.452 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 165.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -72.92 157.08 51.95 Favored 'Trans proline' 0 CA--C 1.589 3.238 0 N-CA-C 121.782 3.724 . . . . 0.0 121.782 -174.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -72.21 135.01 24.04 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 C-N-CA 123.278 2.652 . . . . 0.0 113.123 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.7 27.77 45.45 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 118.821 2.289 . . . . 0.0 118.821 -165.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.28 23.1 m95 -111.3 162.53 14.91 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 120.004 1.902 . . . . 0.0 114.083 170.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.71 -155.15 0.59 Allowed 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 122.193 0.997 . . . . 0.0 112.505 149.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.33 120.37 10.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.913 -1.117 . . . . 0.0 111.567 -159.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.1 mtt-85 -136.66 115.74 12.43 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.24 -1.537 . . . . 0.0 113.338 -160.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.7 mtp -108.89 107.05 17.29 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -158.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.285 5.8 p 65.93 -163.1 0.25 Allowed 'General case' 0 CA--C 1.579 2.076 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 164.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -124.87 -75.18 0.6 Allowed 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.4 p -139.63 85.95 2.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 144.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 21.0 m -155.7 -27.69 0.1 Allowed 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 -158.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.19 44.32 7.61 Favored Glycine 0 N--CA 1.499 2.847 0 CA-C-N 121.213 1.824 . . . . 0.0 115.638 -170.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -137.57 172.5 12.87 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.494 1.118 . . . . 0.0 111.157 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.535 2.2 t 71.82 141.44 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.58 2.122 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 160.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.279 3.0 p90 -170.39 10.48 0.02 OUTLIER 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 -171.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -148.86 145.52 27.52 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 123.183 2.719 . . . . 0.0 113.602 -176.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -151.7 127.2 10.05 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.899 -1.126 . . . . 0.0 111.135 177.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.6 126.66 40.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.216 -1.552 . . . . 0.0 111.003 170.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -79.14 -45.79 19.28 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mt -66.81 -51.78 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 124.302 1.041 . . . . 0.0 112.96 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 85.7 m -56.65 -46.13 81.22 Favored 'General case' 0 CA--C 1.577 2.018 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 163.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.523 0.0 OUTLIER 76.21 65.98 0.06 Allowed 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 125.462 1.505 . . . . 0.0 112.302 -163.72 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -125.09 122.7 37.95 Favored 'General case' 0 CA--C 1.557 1.222 0 O-C-N 121.185 -0.947 . . . . 0.0 110.418 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -99.69 121.43 41.22 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.973 -0.455 . . . . 0.0 110.937 167.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -153.51 171.1 19.24 Favored 'General case' 0 CA--C 1.562 1.407 0 CA-C-O 123.364 1.554 . . . . 0.0 113.21 -164.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.314 0.6 OUTLIER -127.11 51.1 1.91 Allowed 'General case' 0 CA--C 1.567 1.601 0 O-C-N 121.12 -0.988 . . . . 0.0 113.251 166.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -135.93 140.15 43.8 Favored 'General case' 0 CA--C 1.56 1.353 0 CA-C-O 122.238 1.018 . . . . 0.0 110.593 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 52.8 ttp85 -81.26 128.12 71.51 Favored Pre-proline 0 CA--C 1.576 1.961 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.83 171.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -61.25 6.5 0.14 Allowed 'Trans proline' 0 CA--C 1.581 2.843 0 N-CA-C 120.03 3.05 . . . . 0.0 120.03 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.384 37.7 p . . . . . 0 N--CA 1.498 1.973 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 N--CA 1.498 1.944 0 CA-C-O 122.036 0.922 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 16.2 mtp-105 . . . . . 0 CA--C 1.568 1.636 0 CA-C-O 122.322 1.058 . . . . 0.0 113.782 -171.159 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.277 24.3 Cg_endo . . . . . 0 CA--C 1.575 2.566 0 N-CA-C 117.265 1.987 . . . . 0.0 117.265 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.83 -103.26 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.666 0 CA-C-N 125.086 2.852 . . . . 0.0 112.267 162.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? . . . . . 0 CA--C 1.577 1.994 0 CA-C-N 119.613 1.097 . . . . 0.0 112.014 167.417 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 10.5 pttp . . . . . 0 CA--C 1.576 1.956 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.3 171.07 10.52 Favored Pre-proline 0 CA--C 1.589 2.469 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 163.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -73.31 154.83 51.41 Favored 'Trans proline' 0 CA--C 1.59 3.306 0 N-CA-C 122.118 3.853 . . . . 0.0 122.118 -172.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -71.62 129.41 15.61 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.96 2.44 . . . . 0.0 113.009 173.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.64 7.84 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 117.322 1.689 . . . . 0.0 117.322 -160.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -123.4 169.87 10.92 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-N 120.362 2.081 . . . . 0.0 116.477 171.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.07 178.81 8.39 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-O 124.12 1.914 . . . . 0.0 111.836 144.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.271 0.2 OUTLIER -100.42 127.08 46.84 Favored 'General case' 0 CA--C 1.573 1.828 0 CA-C-N 114.135 -1.393 . . . . 0.0 112.406 169.188 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -129.61 126.19 37.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.228 -1.545 . . . . 0.0 109.699 -170.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 86.3 mmm -112.77 136.0 52.88 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -156.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.261 24.3 p 47.86 61.17 3.1 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 121.342 3.83 . . . . 0.0 121.342 137.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -71.31 -15.48 62.41 Favored 'General case' 0 CA--C 1.582 2.18 0 N-CA-C 117.325 2.343 . . . . 0.0 117.325 165.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -131.15 174.66 9.81 Favored 'General case' 0 CA--C 1.578 2.036 0 O-C-N 120.871 -1.143 . . . . 0.0 110.433 155.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 14.7 t -68.75 96.3 0.73 Allowed 'General case' 0 CA--C 1.57 1.729 0 N-CA-C 115.61 1.708 . . . . 0.0 115.61 -164.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.02 55.08 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 115.49 0.956 . . . . 0.0 115.49 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -141.19 163.73 32.18 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.12 0.968 . . . . 0.0 110.398 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.483 1.6 t 66.23 132.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.579 2.089 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 162.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.337 6.5 p90 -165.8 2.57 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.82 0 O-C-N 119.717 -1.864 . . . . 0.0 116.016 -171.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -144.01 156.77 44.52 Favored 'General case' 0 N--CA 1.502 2.148 0 CA-C-N 122.793 2.542 . . . . 0.0 114.142 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -161.75 129.75 4.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.294 -1.504 . . . . 0.0 109.441 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -83.65 125.61 32.03 Favored 'General case' 0 CA--C 1.576 1.943 0 O-C-N 120.106 -1.621 . . . . 0.0 110.645 168.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.75 -45.36 15.76 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 25.4 pt -67.12 -33.5 63.52 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 69.9 p -74.43 -49.59 21.84 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 114.773 1.398 . . . . 0.0 114.773 158.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.329 0.8 OUTLIER 82.6 58.83 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.996 0 C-N-CA 125.93 1.692 . . . . 0.0 112.592 -163.791 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -117.91 123.69 46.43 Favored 'General case' 0 CA--C 1.563 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 111.265 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 28.0 m -88.91 134.03 34.1 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.311 -0.868 . . . . 0.0 112.646 175.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -147.61 172.05 14.63 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 123.73 1.728 . . . . 0.0 113.424 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -121.92 60.62 0.97 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.314 -1.491 . . . . 0.0 110.358 163.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -156.77 130.18 8.07 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-O 121.977 0.894 . . . . 0.0 111.28 -152.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 -93.77 132.78 29.08 Favored Pre-proline 0 CA--C 1.573 1.852 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.168 -175.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -64.76 11.11 0.12 Allowed 'Trans proline' 0 CA--C 1.58 2.782 0 N-CA-C 119.499 2.846 . . . . 0.0 119.499 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.32 9.7 t . . . . . 0 N--CA 1.496 1.872 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.258 13.6 t . . . . . 0 N--CA 1.503 2.208 0 CA-C-O 121.436 0.636 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 122.128 0.966 . . . . 0.0 112.607 -172.511 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo . . . . . 0 CA--C 1.575 2.555 0 N-CA-C 118.804 2.579 . . . . 0.0 118.804 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.03 -63.68 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.282 0 CA-C-N 125.886 3.138 . . . . 0.0 115.532 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.046 . . . . 0.0 112.127 174.776 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 117.056 -1.45 . . . . 0.0 111.652 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.324 1.2 pp 47.82 175.76 0.01 OUTLIER Pre-proline 0 N--CA 1.51 2.559 0 N-CA-C 120.16 3.392 . . . . 0.0 120.16 175.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -78.94 158.05 27.3 Favored 'Trans proline' 0 CA--C 1.587 3.15 0 N-CA-C 122.126 3.856 . . . . 0.0 122.126 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.74 127.02 8.48 Favored 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 123.271 2.648 . . . . 0.0 113.133 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.21 23.82 16.14 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 118.095 1.998 . . . . 0.0 118.095 -163.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.283 22.1 m95 -119.52 169.28 10.19 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 120.87 2.335 . . . . 0.0 115.848 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -134.71 164.88 26.54 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 124.957 2.313 . . . . 0.0 113.731 151.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.33 123.89 30.08 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-N 112.783 -2.008 . . . . 0.0 110.177 142.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 -122.77 102.38 8.0 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 121.684 2.038 . . . . 0.0 110.599 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.43 115.18 29.7 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -155.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 26.5 p 67.7 131.29 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.611 2.449 . . . . 0.0 117.611 168.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.61 -68.92 0.56 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.587 -1.321 . . . . 0.0 107.643 160.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 88.8 p -93.88 111.16 22.82 Favored 'General case' 0 CA--C 1.572 1.815 0 O-C-N 120.819 -1.175 . . . . 0.0 112.706 166.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . 0.278 38.8 p 63.88 40.27 7.57 Favored 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 119.885 3.291 . . . . 0.0 119.885 169.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.73 33.11 38.86 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 117.244 1.658 . . . . 0.0 117.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 9.4 mpt_? -116.96 126.08 52.39 Favored 'General case' 0 CA--C 1.565 1.552 0 CA-C-N 118.487 1.143 . . . . 0.0 111.236 -171.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.846 0.7 OUTLIER 110.4 148.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.417 1.887 . . . . 0.0 114.565 -179.131 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.394 10.2 p90 -170.46 12.23 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.252 0 C-N-CA 126.272 1.829 . . . . 0.0 115.383 176.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -148.47 137.67 21.84 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 122.364 2.347 . . . . 0.0 111.986 165.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -143.02 135.45 27.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.637 -1.914 . . . . 0.0 110.844 173.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.22 120.55 31.47 Favored 'General case' 0 CA--C 1.57 1.739 0 O-C-N 120.203 -1.561 . . . . 0.0 110.536 169.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -76.7 -43.97 35.47 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 26.5 pt -71.64 -35.98 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 80.4 p -71.36 -50.76 29.0 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 159.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.317 34.7 t-20 83.72 64.74 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 126.115 1.766 . . . . 0.0 112.162 -163.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -128.49 118.75 23.6 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 123.514 0.726 . . . . 0.0 111.455 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 89.6 p -86.42 128.23 34.92 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -0.964 . . . . 0.0 113.301 171.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -137.72 177.8 7.59 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.031 1.396 . . . . 0.0 111.887 175.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.366 0.1 OUTLIER -128.74 47.09 2.5 Favored 'General case' 0 CA--C 1.571 1.785 0 O-C-N 119.794 -1.816 . . . . 0.0 114.097 164.092 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -147.56 160.38 42.7 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-O 125.329 2.49 . . . . 0.0 109.587 167.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.313 17.7 ttp-105 -64.53 155.87 79.56 Favored Pre-proline 0 CA--C 1.569 1.709 0 CA-C-N 112.842 -1.981 . . . . 0.0 116.239 171.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.21 65.7 1.46 Allowed 'Trans proline' 0 CA--C 1.573 2.429 0 C-N-CA 122.233 1.955 . . . . 0.0 112.258 154.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 CA--C 1.574 1.883 0 N-CA-C 119.841 3.275 . . . . 0.0 119.841 176.229 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.504 2.261 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? . . . . . 0 N--CA 1.504 2.266 0 N-CA-C 117.507 2.41 . . . . 0.0 117.507 -160.273 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 CA--C 1.578 2.698 0 N-CA-C 117.497 2.076 . . . . 0.0 117.497 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -72.86 92.5 0.79 Allowed 'Trans proline' 0 CA--C 1.566 2.082 0 CA-C-N 125.566 3.023 . . . . 0.0 111.589 171.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.571 1.759 0 CA-C-N 113.519 -1.673 . . . . 0.0 114.664 -165.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? . . . . . 0 CA--C 1.572 1.814 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.87 169.17 10.23 Favored Pre-proline 0 CA--C 1.588 2.42 0 N-CA-C 116.363 1.986 . . . . 0.0 116.363 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -70.88 153.61 63.7 Favored 'Trans proline' 0 CA--C 1.588 3.191 0 N-CA-C 122.157 3.868 . . . . 0.0 122.157 -172.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.21 126.74 10.68 Favored 'Trans proline' 0 CA--C 1.566 2.096 0 C-N-CA 123.183 2.589 . . . . 0.0 112.664 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.89 28.36 10.17 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 -161.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.254 12.6 m95 -114.54 162.96 16.04 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.276 2.038 . . . . 0.0 114.072 171.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -153.92 141.38 19.74 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-O 123.285 1.517 . . . . 0.0 114.916 152.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.44 128.17 35.82 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 166.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -129.59 106.88 9.04 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-N 120.494 1.497 . . . . 0.0 111.441 -174.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 3.2 ttm -114.82 129.3 56.67 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -132.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.344 24.5 p 78.42 157.85 0.17 Allowed 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 154.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -151.42 -50.55 0.12 Allowed 'General case' 0 CA--C 1.57 1.748 0 C-N-CA 124.524 1.13 . . . . 0.0 112.318 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 93.2 p -100.16 -61.89 1.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.0 112.786 157.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 97.3 p -119.15 -59.49 1.84 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -163.52 45.28 0.32 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 116.863 1.505 . . . . 0.0 116.863 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.12 144.32 44.3 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.548 1.139 . . . . 0.0 113.303 169.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.731 0.5 OUTLIER 73.45 124.84 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 CA-C-N 115.274 -0.875 . . . . 0.0 112.416 -142.68 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.308 9.8 p90 -172.29 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.16 0 CA-C-O 116.08 -1.914 . . . . 0.0 114.841 -174.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -153.85 148.79 26.66 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 124.357 3.253 . . . . 0.0 115.591 174.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -161.48 136.55 7.44 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 125.903 1.681 . . . . 0.0 109.123 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.12 128.47 44.07 Favored 'General case' 0 CA--C 1.571 1.752 0 O-C-N 120.27 -1.519 . . . . 0.0 110.642 172.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -75.16 -55.83 5.33 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.162 -1.586 . . . . 0.0 114.163 174.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -60.64 -35.16 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.36 -17.42 23.57 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 164.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.326 3.0 t-20 64.59 24.44 13.02 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 -164.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.54 150.73 43.27 Favored 'General case' 0 CA--C 1.573 1.863 0 O-C-N 119.599 -1.938 . . . . 0.0 114.273 164.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.4 m -152.56 122.09 6.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.964 -1.71 . . . . 0.0 111.2 -170.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -162.55 177.08 9.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 124.051 1.882 . . . . 0.0 112.952 -150.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.273 0.1 OUTLIER -119.01 39.44 3.54 Favored 'General case' 0 CA--C 1.577 1.995 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.824 155.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -127.13 134.14 50.25 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 122.394 1.093 . . . . 0.0 110.396 -167.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -90.56 123.97 63.84 Favored Pre-proline 0 CA--C 1.574 1.903 0 CA-C-O 117.897 -1.049 . . . . 0.0 113.512 -172.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -60.02 -39.83 66.89 Favored 'Trans proline' 0 CA--C 1.569 2.261 0 N-CA-C 117.845 2.21 . . . . 0.0 117.845 171.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.34 1.2 m . . . . . 0 N--CA 1.499 2.011 0 C-N-CA 125.134 1.374 . . . . 0.0 114.606 -165.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.333 2.4 t . . . . . 0 N--CA 1.503 2.207 0 CA-C-O 121.262 0.553 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.264 24.2 ptt-85 . . . . . 0 N--CA 1.501 2.113 0 O-C-N 119.878 -1.763 . . . . 0.0 115.759 -156.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.293 18.1 Cg_endo . . . . . 0 CA--C 1.582 2.912 0 N-CA-C 119.548 2.865 . . . . 0.0 119.548 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -70.37 -49.31 0.48 Allowed 'Trans proline' 0 CA--C 1.567 2.127 0 CA-C-N 126.187 3.245 . . . . 0.0 117.487 -174.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.801 0 O-C-N 120.912 -1.118 . . . . 0.0 111.912 165.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 20.4 tptm . . . . . 0 CA--C 1.577 2.006 0 CA-C-O 120.941 0.401 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -144.59 176.28 2.33 Favored Pre-proline 0 CA--C 1.587 2.38 0 C-N-CA 124.471 1.109 . . . . 0.0 109.485 164.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -76.13 157.32 38.07 Favored 'Trans proline' 0 CA--C 1.584 3.016 0 N-CA-C 121.21 3.504 . . . . 0.0 121.21 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -79.19 124.33 5.95 Favored 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.117 2.545 . . . . 0.0 112.879 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.39 30.7 9.62 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 117.944 1.937 . . . . 0.0 117.944 -164.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . 0.429 ' CZ2' ' HG3' ' B' ' 32' ' ' PRO 0.268 22.4 m95 -114.13 162.82 16.02 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.506 1.653 . . . . 0.0 114.102 170.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -147.75 -148.62 0.26 Allowed 'General case' 0 CA--C 1.573 1.83 0 CA-C-O 121.93 0.871 . . . . 0.0 112.468 149.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.77 118.24 9.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.76 -1.212 . . . . 0.0 111.157 -161.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 mtt-85 -140.75 121.72 14.58 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.184 -1.573 . . . . 0.0 112.075 -161.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.5 mtp -113.18 142.33 45.9 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 118.355 2.724 . . . . 0.0 118.355 -150.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.301 46.7 m 65.57 62.11 0.67 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 118.495 2.776 . . . . 0.0 118.495 155.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' ARG . . . . . 0.422 ' H ' HG12 ' B' ' 17' ' ' VAL . 16.0 mtp180 -65.75 -29.26 69.75 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 156.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 74.9 m -133.63 136.78 45.04 Favored 'General case' 0 CA--C 1.563 1.469 0 O-C-N 120.477 -1.39 . . . . 0.0 108.588 156.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 49.9 m -35.23 102.26 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 119.068 2.988 . . . . 0.0 119.068 -165.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 99.18 -0.4 57.27 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 119.047 2.379 . . . . 0.0 119.047 -173.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? -127.59 128.15 45.08 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 120.484 2.142 . . . . 0.0 112.371 -166.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . 0.422 HG12 ' H ' ' B' ' 12' ' ' ARG 0.82 0.3 OUTLIER 99.46 135.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 C-N-CA 125.892 1.677 . . . . 0.0 112.217 -160.199 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.3 2.5 p90 -173.74 9.49 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.325 0 C-N-CA 126.184 1.794 . . . . 0.0 115.712 -170.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -147.27 144.92 29.19 Favored 'General case' 0 N--CA 1.511 2.603 0 CA-C-N 122.673 2.488 . . . . 0.0 112.982 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -152.89 129.79 10.98 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.137 -1.602 . . . . 0.0 112.666 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.71 125.04 37.15 Favored 'General case' 0 CA--C 1.573 1.831 0 O-C-N 120.197 -1.564 . . . . 0.0 111.063 168.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 -68.6 -42.5 78.07 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 9.0 mt -71.4 -54.84 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.166 0.986 . . . . 0.0 112.763 -171.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' THR . . . . . 0.451 HG23 ' H ' ' B' ' 26' ' ' ALA . 9.1 t -81.33 -15.98 53.74 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 171.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.285 6.4 t-20 61.9 17.47 8.94 Favored 'General case' 0 CA--C 1.582 2.193 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 -160.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' ALA . . . . . 0.451 ' H ' HG23 ' B' ' 24' ' ' THR . . . -58.9 96.85 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 O-C-N 119.874 -1.766 . . . . 0.0 113.29 162.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 9.3 m -113.59 122.75 48.15 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -170.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.86 163.69 38.91 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 124.154 1.931 . . . . 0.0 115.074 -154.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -102.42 49.12 0.85 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 113.846 -1.524 . . . . 0.0 112.378 168.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -161.04 138.77 9.33 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 123.092 1.425 . . . . 0.0 111.045 -148.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 68.8 ttt-85 -107.33 112.54 62.67 Favored Pre-proline 0 CA--C 1.573 1.839 0 CA-C-O 117.772 -1.109 . . . . 0.0 112.884 -155.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . 0.429 ' HG3' ' CZ2' ' B' ' 6' ' ' TRP . 39.2 Cg_endo -68.36 -48.5 1.17 Allowed 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 122.408 2.072 . . . . 0.0 115.335 174.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.498 1.951 0 N-CA-C 118.828 2.899 . . . . 0.0 118.828 177.353 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.6 t . . . . . 0 N--CA 1.505 2.305 0 CA-C-O 123.937 1.827 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.574 1.888 0 CA-C-N 113.435 -1.711 . . . . 0.0 115.099 -172.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.253 6.3 Cg_exo . . . . . 0 CA--C 1.573 2.442 0 N-CA-C 118.524 2.471 . . . . 0.0 118.524 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -80.25 -111.61 0.01 OUTLIER 'Trans proline' 0 CA--C 1.572 2.397 0 CA-C-N 125.343 2.944 . . . . 0.0 112.507 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.568 1.648 0 O-C-N 120.317 -1.489 . . . . 0.0 110.388 172.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? . . . . . 0 CA--C 1.57 1.736 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -63.08 170.82 2.35 Favored Pre-proline 0 CA--C 1.586 2.364 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . 0.25 33.6 Cg_exo -68.1 155.6 68.93 Favored 'Trans proline' 0 CA--C 1.593 3.44 0 N-CA-C 122.45 3.981 . . . . 0.0 122.45 -172.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -73.41 135.73 22.79 Favored 'Trans proline' 0 CA--C 1.563 1.975 0 C-N-CA 123.311 2.674 . . . . 0.0 112.694 175.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.06 32.15 26.91 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 -161.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.261 17.1 m95 -116.68 162.44 17.65 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 120.589 2.195 . . . . 0.0 114.521 170.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.95 -148.1 0.24 Allowed 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.966 0.889 . . . . 0.0 111.671 150.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -149.49 118.93 6.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.227 -1.546 . . . . 0.0 110.415 -163.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -137.93 115.48 11.26 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.098 -1.626 . . . . 0.0 114.449 -161.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.11 114.04 27.62 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -152.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 78.9 p 46.7 87.33 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 119.998 3.332 . . . . 0.0 119.998 169.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . 0.256 0.0 OUTLIER -56.03 -40.49 73.53 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 173.005 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 84.9 p -160.6 55.49 0.32 Allowed 'General case' 0 CA--C 1.576 1.974 0 C-N-CA 124.283 1.033 . . . . 0.0 111.584 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -164.82 -114.34 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.399 -1.438 . . . . 0.0 109.809 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -161.33 26.69 0.27 Allowed Glycine 0 N--CA 1.498 2.816 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 172.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -138.47 170.7 15.56 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 125.019 1.327 . . . . 0.0 109.408 171.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.809 0.3 OUTLIER 93.31 131.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 120.774 -1.204 . . . . 0.0 111.723 -156.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.339 1.4 p90 -177.83 8.73 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.477 0 C-N-CA 126.084 1.754 . . . . 0.0 114.606 -167.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -136.12 137.44 41.01 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 119.185 -2.197 . . . . 0.0 109.373 174.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -140.12 130.28 25.04 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 119.509 -1.994 . . . . 0.0 112.922 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.63 129.7 39.81 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.091 -1.631 . . . . 0.0 111.149 171.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -82.69 -53.56 5.82 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 175.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 31.1 pt -62.94 -50.0 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 94.5 m -58.17 -42.3 85.71 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 158.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.314 11.5 t-20 77.5 73.02 0.06 Allowed 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 125.763 1.625 . . . . 0.0 109.433 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -152.0 134.56 15.38 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.535 -0.728 . . . . 0.0 111.811 -169.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 92.5 p -86.62 131.7 34.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.023 -1.048 . . . . 0.0 112.555 161.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.274 1.3 pt20 -133.68 161.72 33.89 Favored 'General case' 0 CA--C 1.566 1.571 0 CA-C-O 122.573 1.177 . . . . 0.0 112.682 167.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.276 0.1 OUTLIER -108.87 19.61 19.42 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 170.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -157.56 38.89 0.28 Allowed 'General case' 0 CA--C 1.567 1.607 0 N-CA-C 119.869 3.285 . . . . 0.0 119.869 -171.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 54.28 142.67 0.03 OUTLIER Pre-proline 0 CA--C 1.59 2.493 0 N-CA-C 121.393 3.849 . . . . 0.0 121.393 166.379 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -69.45 3.24 2.74 Favored 'Trans proline' 0 CA--C 1.578 2.684 0 N-CA-C 118.36 2.408 . . . . 0.0 118.36 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.358 8.6 m . . . . . 0 N--CA 1.501 2.083 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 -172.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 119.028 -0.511 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -71.94 144.04 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 CA-C-N 119.242 0.928 . . . . 0.0 112.236 168.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.2 t -148.93 141.18 24.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.868 -1.145 . . . . 0.0 113.51 -175.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.7 155.2 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.091 0 O-C-N 121.63 -0.669 . . . . 0.0 111.59 150.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.0 t -76.99 123.33 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 CA-C-O 121.971 0.891 . . . . 0.0 109.081 174.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.75 99.11 9.32 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 122.598 1.19 . . . . 0.0 113.555 -172.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.294 9.7 Cg_endo -53.3 -53.64 6.32 Favored 'Trans proline' 0 CA--C 1.578 2.694 0 CA-C-N 123.929 2.439 . . . . 0.0 117.89 -173.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -83.06 -117.62 0.01 OUTLIER 'Trans proline' 0 CA--C 1.582 2.915 0 CA-C-N 123.987 2.46 . . . . 0.0 111.885 162.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.401 ' HZ2' ' C ' ' A' ' 13' ' ' SER . 14.4 pttp -147.55 178.11 8.71 Favored 'General case' 0 CA--C 1.576 1.95 0 O-C-N 120.202 -1.561 . . . . 0.0 111.244 164.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.7 t -65.21 138.25 97.17 Favored Pre-proline 0 CA--C 1.584 2.268 0 O-C-N 120.54 -1.35 . . . . 0.0 113.736 164.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -78.19 49.56 3.04 Favored 'Trans proline' 0 CA--C 1.577 2.65 0 N-CA-C 118.467 2.449 . . . . 0.0 118.467 -176.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.401 ' C ' ' HZ2' ' A' ' 10' ' ' LYS . 11.5 t . . . . . 0 C--O 1.254 1.298 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 152.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 CA--C 1.581 2.162 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pp -74.71 171.66 10.94 Favored Pre-proline 0 CA--C 1.589 2.477 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -72.79 156.27 53.11 Favored 'Trans proline' 0 CA--C 1.586 3.107 0 N-CA-C 121.958 3.792 . . . . 0.0 121.958 -174.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.28 129.26 15.72 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 C-N-CA 123.029 2.486 . . . . 0.0 113.605 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.95 28.82 24.87 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 118.578 2.191 . . . . 0.0 118.578 -167.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.251 16.5 m95 -109.76 177.09 4.83 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 120.241 2.021 . . . . 0.0 116.352 173.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -148.56 162.36 39.81 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-O 124.122 1.915 . . . . 0.0 111.081 147.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.254 0.1 OUTLIER -101.14 116.75 33.54 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.541 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -101.05 160.23 14.55 Favored 'General case' 0 CA--C 1.557 1.224 0 O-C-N 120.093 -1.63 . . . . 0.0 107.98 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.18 125.04 13.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -173.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.292 20.7 p 74.99 146.63 0.09 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 119.047 2.98 . . . . 0.0 119.047 157.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 39.8 mtm-85 -130.0 -68.64 0.7 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.91 -1.119 . . . . 0.0 110.11 162.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 96.2 p -115.68 -70.65 0.78 Allowed 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 119.194 0.907 . . . . 0.0 111.941 170.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 34.0 t -72.18 1.98 6.66 Favored 'General case' 0 CA--C 1.579 2.096 0 N-CA-C 119.227 3.047 . . . . 0.0 119.227 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.66 54.61 1.91 Allowed Glycine 0 N--CA 1.489 2.169 0 CA-C-N 120.704 1.593 . . . . 0.0 113.628 -177.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -136.29 137.77 41.05 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 123.207 1.479 . . . . 0.0 113.676 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.802 1.1 p 135.1 148.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 C-N-CA 129.239 3.016 . . . . 0.0 111.642 177.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.345 52.4 m-85 -135.95 -48.2 0.67 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -159.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -155.38 146.82 22.91 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 123.11 1.433 . . . . 0.0 113.615 -160.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -151.42 122.53 7.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.512 -1.367 . . . . 0.0 108.55 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.35 124.24 27.6 Favored 'General case' 0 CA--C 1.57 1.744 0 O-C-N 119.736 -1.852 . . . . 0.0 110.833 174.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.33 -46.82 11.37 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -175.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.5 pt -61.82 -45.09 99.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.281 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 172.595 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 55.3 m -66.58 -48.11 70.63 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 165.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.343 53.4 m-80 77.97 68.41 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.673 0 C-N-CA 126.499 1.92 . . . . 0.0 112.656 -166.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -137.71 124.5 21.16 Favored 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.777 0.831 . . . . 0.0 110.739 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 37.4 m -83.39 142.26 31.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.377 -0.827 . . . . 0.0 112.892 172.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.27 10.1 pt20 -148.17 173.42 12.99 Favored 'General case' 0 CA--C 1.562 1.426 0 CA-C-O 123.58 1.657 . . . . 0.0 113.305 166.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.305 0.1 OUTLIER -111.33 39.69 2.25 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 169.297 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.11 160.1 40.71 Favored 'General case' 0 CA--C 1.563 1.472 0 CA-C-O 123.728 1.727 . . . . 0.0 111.228 174.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.25 15.2 ttt85 -54.2 157.49 4.56 Favored Pre-proline 0 CA--C 1.585 2.314 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 159.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -60.52 17.9 0.04 OUTLIER 'Trans proline' 0 CA--C 1.584 3.02 0 N-CA-C 119.173 2.72 . . . . 0.0 119.173 164.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.322 8.4 t 67.58 -76.69 0.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.538 1.535 . . . . 0.0 114.253 -172.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 50.77 51.88 32.02 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 120.715 3.046 . . . . 0.0 120.715 172.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -142.12 101.27 3.89 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 117.821 0.81 . . . . 0.0 109.585 -177.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 18.0 m -69.98 155.25 40.85 Favored 'General case' 0 CA--C 1.57 1.719 0 N-CA-C 116.02 1.859 . . . . 0.0 116.02 -177.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 58.4 m -148.6 -59.49 0.23 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.094 -1.004 . . . . 0.0 112.622 174.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 77.9 p -125.57 72.15 1.25 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.212 -0.93 . . . . 0.0 109.767 165.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.075 0 CA-C-O 118.89 -0.95 . . . . 0.0 110.982 -145.442 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.7 tptm . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 119.274 -0.393 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.9 t -79.0 142.14 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 CA-C-N 118.702 0.683 . . . . 0.0 110.206 168.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.7 t -142.78 112.24 6.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.28 -0.887 . . . . 0.0 110.567 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 72.3 t -78.21 102.86 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.302 3.4 t 76.94 112.42 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 C-N-CA 124.439 1.096 . . . . 0.0 109.797 -168.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 35.0 ttp85 -143.59 148.16 35.46 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.969 -1.082 . . . . 0.0 113.471 -168.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.282 13.4 Cg_endo -57.96 -61.12 0.3 Allowed 'Trans proline' 0 CA--C 1.585 3.052 0 C-N-CA 122.68 2.254 . . . . 0.0 116.805 169.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -80.06 -111.37 0.01 OUTLIER 'Trans proline' 0 CA--C 1.578 2.704 0 CA-C-N 125.018 2.828 . . . . 0.0 112.942 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.452 ' HZ3' ' C ' ' A' ' 13' ' ' SER . 57.0 pttt -157.51 159.95 37.73 Favored 'General case' 0 CA--C 1.573 1.841 0 O-C-N 120.546 -1.347 . . . . 0.0 112.194 167.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.3 t -58.94 147.7 72.46 Favored Pre-proline 0 CA--C 1.586 2.338 0 CA-C-O 117.555 -1.212 . . . . 0.0 113.789 154.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.53 75.64 3.42 Favored 'Trans proline' 0 CA--C 1.573 2.439 0 CA-C-N 123.372 2.24 . . . . 0.0 117.414 -170.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.452 ' C ' ' HZ3' ' A' ' 10' ' ' LYS . 79.3 p . . . . . 0 N--CA 1.484 1.229 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 171.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.584 2.255 0 N-CA-C 118.071 2.619 . . . . 0.0 118.071 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.372 0.6 OUTLIER 50.41 163.62 0.04 OUTLIER Pre-proline 0 CA--C 1.59 2.481 0 N-CA-C 118.205 2.668 . . . . 0.0 118.205 -157.313 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -77.72 156.02 31.34 Favored 'Trans proline' 0 CA--C 1.591 3.366 0 N-CA-C 121.927 3.78 . . . . 0.0 121.927 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.34 130.54 15.23 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.135 2.556 . . . . 0.0 112.648 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.72 25.74 17.04 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 118.017 1.967 . . . . 0.0 118.017 -161.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.276 26.5 m95 -117.61 171.46 8.01 Favored 'General case' 0 CA--C 1.561 1.398 0 CA-C-N 120.387 2.094 . . . . 0.0 115.856 172.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -157.55 137.18 12.16 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 122.454 1.121 . . . . 0.0 113.187 147.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.67 127.53 32.76 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 174.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . 0.426 HH11 ' HG2' ' B' ' 9' ' ' ARG . 14.8 mtt-85 -137.07 111.62 8.65 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.996 -1.69 . . . . 0.0 110.737 -167.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 28.7 mtp -114.6 141.76 47.34 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 116.906 2.188 . . . . 0.0 116.906 -138.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.266 54.3 p 60.68 64.99 1.09 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 137.228 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 62.1 mtm180 -88.63 -12.18 43.25 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 68.9 m -144.64 -112.29 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.483 -1.386 . . . . 0.0 108.255 166.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 48.2 m -86.48 56.56 4.05 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 121.45 1.932 . . . . 0.0 115.176 -175.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.5 53.3 6.07 Favored Glycine 0 N--CA 1.489 2.174 0 O-C-N 120.514 -1.366 . . . . 0.0 114.719 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -132.8 144.47 50.26 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 122.259 1.028 . . . . 0.0 112.191 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.678 0.5 OUTLIER 73.27 135.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -159.113 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.351 1.9 p90 -175.02 7.07 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.311 0 C-N-CA 126.281 1.833 . . . . 0.0 114.905 -169.308 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -146.49 148.11 31.89 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 122.42 2.373 . . . . 0.0 112.76 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -150.58 123.37 8.64 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.112 -1.617 . . . . 0.0 108.199 173.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.28 126.1 33.43 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 119.959 -1.713 . . . . 0.0 110.641 172.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -88.17 -46.68 9.06 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.297 1.962 . . . . 0.0 116.297 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 33.5 pt -58.93 -40.26 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 56.4 m -71.55 -45.48 62.21 Favored 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 160.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.327 6.2 t30 79.04 67.91 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 125.838 1.655 . . . . 0.0 112.366 -169.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -142.38 122.65 13.88 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.391 0.676 . . . . 0.0 111.641 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 79.4 p -81.04 134.15 35.62 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -153.4 167.6 28.87 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.259 0.2 OUTLIER -113.3 36.92 3.35 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-N 113.622 -1.626 . . . . 0.0 114.986 169.937 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -148.14 157.4 43.48 Favored 'General case' 0 CA--C 1.571 1.767 0 CA-C-O 125.588 2.613 . . . . 0.0 111.408 167.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.341 18.7 ttp-105 -69.05 150.98 97.41 Favored Pre-proline 0 CA--C 1.58 2.13 0 CA-C-N 112.09 -2.323 . . . . 0.0 115.655 174.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.34 -35.92 98.89 Favored 'Trans proline' 0 CA--C 1.57 2.278 0 C-N-CA 122.614 2.209 . . . . 0.0 117.083 168.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.314 1.6 t 73.0 -41.1 0.49 Allowed 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 165.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.86 25.55 69.18 Favored Glycine 0 N--CA 1.499 2.857 0 N-CA-C 120.015 2.766 . . . . 0.0 120.015 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -92.18 84.88 5.31 Favored 'General case' 0 CA--C 1.567 1.632 0 CA-C-N 119.045 1.422 . . . . 0.0 112.061 -171.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 23.1 t -136.82 -62.1 0.65 Allowed 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 123.306 0.642 . . . . 0.0 112.517 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 7.3 m -75.89 110.19 10.14 Favored 'General case' 0 CA--C 1.565 1.524 0 CA-C-O 124.478 2.085 . . . . 0.0 113.816 175.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 31.6 t -99.96 64.85 1.25 Allowed 'General case' 0 CA--C 1.575 1.907 0 CA-C-N 112.148 -2.297 . . . . 0.0 110.486 138.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.935 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -150.608 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.575 1.932 0 CA-C-O 119.183 -0.437 . . . . 0.0 110.713 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.9 t -78.39 142.06 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.418 0 CA-C-N 119.924 1.238 . . . . 0.0 111.391 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.1 m -94.41 -65.82 0.96 Allowed 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.773 -1.204 . . . . 0.0 112.892 165.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.0 m -78.77 112.5 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 CA-C-N 119.764 1.166 . . . . 0.0 111.748 176.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.9 t -83.26 77.86 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 CA-C-O 125.401 2.524 . . . . 0.0 111.355 -169.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.11 149.51 47.52 Favored 'General case' 0 CA--C 1.575 1.926 0 CA-C-N 111.276 -2.693 . . . . 0.0 115.354 -172.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TPO . . . . . 1.173 ' O1P' ' O ' ' A' ' 13' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.31 36.9 Cg_endo -84.81 -85.76 0.0 OUTLIER 'Trans proline' 0 CA--C 1.586 3.094 0 C-N-CA 123.702 2.935 . . . . 0.0 114.952 177.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -77.48 81.17 2.72 Favored 'Trans proline' 0 CA--C 1.57 2.312 0 CA-C-N 127.969 3.882 . . . . 0.0 112.809 173.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 151.84 44.63 Favored 'General case' 0 CA--C 1.57 1.728 0 N-CA-C 120.482 3.512 . . . . 0.0 120.482 -144.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.7 166.54 0.3 Allowed Pre-proline 0 CA--C 1.578 2.046 0 N-CA-C 115.991 1.849 . . . . 0.0 115.991 150.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -52.19 -48.71 20.34 Favored 'Trans proline' 0 CA--C 1.574 2.5 0 CA-C-N 123.491 2.283 . . . . 0.0 115.833 166.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 1.173 ' O ' ' O1P' ' A' ' 7' ' ' TPO . 13.5 t . . . . . 0 CA--C 1.57 1.74 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 154.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . 0.456 ' HZ2' ' C ' ' B' ' 39' ' ' GLY . 55.2 pttt . . . . . 0 CA--C 1.573 1.843 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 pp -115.35 175.59 1.84 Allowed Pre-proline 0 CA--C 1.588 2.409 0 CA-C-O 118.513 -0.756 . . . . 0.0 112.167 159.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -80.0 158.57 23.95 Favored 'Trans proline' 0 CA--C 1.59 3.299 0 N-CA-C 122.218 3.892 . . . . 0.0 122.218 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -78.47 129.87 9.62 Favored 'Trans proline' 0 CA--C 1.564 2.017 0 C-N-CA 123.233 2.622 . . . . 0.0 112.735 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.22 25.96 20.05 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 117.975 1.95 . . . . 0.0 117.975 -162.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.273 26.0 m95 -113.82 164.4 13.8 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-N 119.804 1.802 . . . . 0.0 114.662 172.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -145.17 -154.58 0.55 Allowed 'General case' 0 CA--C 1.569 1.708 0 CA-C-O 122.397 1.094 . . . . 0.0 112.219 147.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -145.28 119.61 9.59 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.816 -1.177 . . . . 0.0 111.293 -160.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -139.76 115.38 10.05 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.263 -1.523 . . . . 0.0 111.486 -161.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 26.8 mtp -114.32 142.07 46.79 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 117.985 2.587 . . . . 0.0 117.985 -139.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.323 55.9 p 71.59 75.83 0.17 Allowed 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 117.56 2.429 . . . . 0.0 117.56 151.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . 0.451 HH21 ' C ' ' A' ' 13' ' ' SER . 24.8 mtp180 -102.48 -13.44 17.23 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 164.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 72.1 m -144.23 -157.03 0.75 Allowed 'General case' 0 CA--C 1.581 2.16 0 O-C-N 119.957 -1.715 . . . . 0.0 109.643 163.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 74.3 p -71.37 88.53 0.88 Allowed 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.328 -2.107 . . . . 0.0 115.105 -174.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.23 46.0 45.29 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 116.122 1.209 . . . . 0.0 116.122 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -134.2 122.74 23.22 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 117.975 0.887 . . . . 0.0 110.414 -163.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.783 0.3 OUTLIER 85.84 129.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 C-N-CA 124.712 1.205 . . . . 0.0 112.892 -168.204 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -177.09 5.69 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.976 0 C-N-CA 126.508 1.923 . . . . 0.0 115.607 -162.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -146.51 142.53 28.15 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 123.303 2.774 . . . . 0.0 112.3 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -147.47 127.82 13.96 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.324 1.049 . . . . 0.0 110.558 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.54 122.49 37.18 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 120.118 -1.614 . . . . 0.0 111.213 172.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -76.36 -53.25 8.45 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 178.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -65.27 -45.9 92.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 89.6 m -61.5 -45.17 95.35 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.288 13.3 t30 82.76 65.55 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 125.706 1.602 . . . . 0.0 112.269 -170.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -143.73 112.41 6.54 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.601 0.715 . . . . 0.0 112.217 -173.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 76.1 p -80.88 134.88 35.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.99 -1.069 . . . . 0.0 113.591 163.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -161.56 157.97 25.61 Favored 'General case' 0 CA--C 1.564 1.5 0 CA-C-O 123.342 1.544 . . . . 0.0 113.867 -171.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.283 0.5 OUTLIER -101.01 42.54 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.748 -1.114 . . . . 0.0 113.528 160.112 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -132.18 139.5 48.4 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.472 1.13 . . . . 0.0 111.712 -170.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 -90.04 130.28 42.98 Favored Pre-proline 0 CA--C 1.577 1.993 0 CA-C-O 118.021 -0.99 . . . . 0.0 113.164 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.19 -37.19 93.17 Favored 'Trans proline' 0 CA--C 1.574 2.506 0 C-N-CA 122.713 2.276 . . . . 0.0 116.532 172.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t -82.54 -0.62 47.54 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 117.845 2.535 . . . . 0.0 117.845 167.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.11 62.64 0.54 Allowed Glycine 0 N--CA 1.502 3.055 0 O-C-N 119.805 -1.81 . . . . 0.0 115.342 155.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 60.1 t-20 -164.99 147.66 8.23 Favored 'General case' 0 CA--C 1.567 1.604 0 C-N-CA 123.422 0.689 . . . . 0.0 109.527 -153.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 66.1 m -61.3 -35.94 78.73 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 165.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 82.8 p -85.41 110.08 18.89 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 119.999 1.272 . . . . 0.0 112.699 162.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -134.2 133.6 41.09 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 114.115 -1.402 . . . . 0.0 109.713 166.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . 0.456 ' C ' ' HZ2' ' B' ' 1' ' ' LYS . . . . . . . . 0 N--CA 1.487 2.067 0 O-C-N 121.587 -0.696 . . . . 0.0 113.885 -177.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.7 pttm . . . . . 0 CA--C 1.57 1.729 0 CA-C-O 118.948 -0.549 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.1 t -83.55 155.55 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 CA-C-N 119.113 0.869 . . . . 0.0 110.355 171.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.0 p -73.66 77.95 1.52 Allowed 'General case' 0 CA--C 1.575 1.912 0 O-C-N 120.582 -1.324 . . . . 0.0 113.085 165.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.471 13.5 t 68.21 -115.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 C-N-CA 123.85 0.86 . . . . 0.0 110.755 -170.641 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.3 t -135.76 129.23 48.11 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.815 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 167.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.1 124.85 18.25 Favored 'General case' 0 CA--C 1.575 1.926 0 O-C-N 120.358 -1.463 . . . . 0.0 111.483 -159.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.382 18.1 Cg_endo -60.66 -81.4 0.01 OUTLIER 'Trans proline' 0 CA--C 1.585 3.05 0 C-N-CA 123.246 2.631 . . . . 0.0 118.523 -159.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.0 154.06 42.21 Favored 'Trans proline' 0 CA--C 1.569 2.264 0 CA-C-N 126.627 3.403 . . . . 0.0 113.442 167.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.91 92.61 3.74 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.562 -1.336 . . . . 0.0 114.206 -172.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.0 m -79.84 172.56 9.55 Favored Pre-proline 0 CA--C 1.586 2.331 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 159.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -71.93 78.95 1.71 Allowed 'Trans proline' 0 CA--C 1.574 2.5 0 CA-C-N 124.021 2.472 . . . . 0.0 114.84 175.015 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 CA--C 1.562 1.406 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 -161.265 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 49.7 tttm . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pp -147.44 164.94 20.39 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 174.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -82.06 158.93 18.08 Favored 'Trans proline' 0 CA--C 1.587 3.127 0 N-CA-C 121.963 3.794 . . . . 0.0 121.963 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.07 113.56 2.74 Favored 'Trans proline' 0 CA--C 1.564 2.019 0 C-N-CA 123.357 2.704 . . . . 0.0 112.611 -175.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 24.16 5.66 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -163.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.281 24.1 m95 -115.36 162.59 16.91 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.559 1.68 . . . . 0.0 114.21 175.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 -151.01 0.35 Allowed 'General case' 0 CA--C 1.573 1.861 0 CA-C-O 121.838 0.828 . . . . 0.0 112.09 150.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.77 118.18 7.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.637 -1.29 . . . . 0.0 111.759 -160.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.7 mtt-85 -137.32 113.94 10.32 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 119.992 -1.692 . . . . 0.0 112.923 -159.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -120.47 121.0 37.51 Favored 'General case' 0 CA--C 1.563 1.463 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -130.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.279 5.4 t 71.05 132.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 118.741 2.867 . . . . 0.0 118.741 163.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -124.87 -56.21 1.58 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.297 -1.502 . . . . 0.0 112.424 157.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 97.0 p -74.74 -43.04 57.02 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 58.1 m -158.47 -54.72 0.07 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.929 -1.107 . . . . 0.0 112.401 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -166.49 64.61 0.21 Allowed Glycine 0 N--CA 1.49 2.294 0 O-C-N 120.944 -1.097 . . . . 0.0 112.813 173.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -149.98 146.81 27.23 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.593 1.187 . . . . 0.0 112.636 -174.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.711 0.5 OUTLIER 79.73 130.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 120.882 -1.136 . . . . 0.0 112.641 -144.576 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.291 1.1 p90 -175.34 4.32 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.215 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -165.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -143.33 141.13 30.86 Favored 'General case' 0 N--CA 1.511 2.613 0 CA-C-N 122.772 2.533 . . . . 0.0 112.801 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -143.9 125.94 15.42 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.585 -1.322 . . . . 0.0 112.303 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.66 125.74 34.98 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.062 -1.649 . . . . 0.0 111.193 172.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -77.68 -50.93 11.45 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 175.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 24.4 mm -65.77 -46.38 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -62.54 -43.61 98.38 Favored 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 162.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.519 0.1 OUTLIER 75.79 74.85 0.09 Allowed 'General case' 0 CA--C 1.571 1.759 0 C-N-CA 125.656 1.583 . . . . 0.0 112.578 -163.588 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -141.43 109.59 5.85 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.017 -1.052 . . . . 0.0 111.263 -176.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p -82.23 126.25 31.88 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.541 -0.725 . . . . 0.0 112.822 166.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -146.32 170.14 17.39 Favored 'General case' 0 CA--C 1.565 1.524 0 CA-C-O 123.76 1.743 . . . . 0.0 114.913 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.31 1.9 p-90 -115.96 43.23 2.17 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 166.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.42 159.74 41.46 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 123.125 1.44 . . . . 0.0 110.516 162.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -90.48 142.71 28.38 Favored Pre-proline 0 CA--C 1.58 2.125 0 CA-C-N 114.829 -1.078 . . . . 0.0 112.469 166.387 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -60.15 -2.0 1.56 Allowed 'Trans proline' 0 CA--C 1.582 2.906 0 C-N-CA 123.589 2.859 . . . . 0.0 119.141 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.317 7.1 t 72.68 -65.01 0.37 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.81 61.47 1.94 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 116.854 1.502 . . . . 0.0 116.854 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -141.58 115.85 9.44 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 123.88 0.872 . . . . 0.0 109.227 175.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 84.0 p -83.52 78.59 9.64 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 176.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 38.8 m -152.21 115.03 4.61 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 122.57 1.176 . . . . 0.0 108.574 164.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 94.3 p -148.88 101.36 3.17 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.383 177.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 CA-C-O 118.9 -0.944 . . . . 0.0 111.397 -178.495 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.6 tttp . . . . . 0 N--CA 1.495 1.806 0 CA-C-O 119.198 -0.429 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.36 143.42 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 173.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.9 m -163.63 143.02 8.21 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.087 -1.008 . . . . 0.0 111.991 -175.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.9 p -76.29 94.87 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.023 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.0 t 65.58 106.1 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 C-N-CA 124.993 1.317 . . . . 0.0 112.64 170.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.0 162.47 13.21 Favored 'General case' 0 CA--C 1.573 1.836 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -166.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.336 30.6 Cg_endo -73.2 -79.92 0.01 OUTLIER 'Trans proline' 0 CA--C 1.586 3.087 0 N-CA-C 118.702 2.539 . . . . 0.0 118.702 -172.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -66.52 142.32 64.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 CA-C-N 126.854 3.484 . . . . 0.0 115.149 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -103.38 99.32 9.15 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -157.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -63.64 134.8 96.01 Favored Pre-proline 0 CA--C 1.585 2.305 0 CA-C-O 117.39 -1.291 . . . . 0.0 112.678 107.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -53.09 -60.54 0.68 Allowed 'Trans proline' 0 CA--C 1.57 2.297 0 C-N-CA 123.123 2.549 . . . . 0.0 116.203 -176.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.6 m . . . . . 0 N--CA 1.484 1.23 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 140.066 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 tptp . . . . . 0 N--CA 1.495 1.82 0 N-CA-C 111.025 0.009 . . . . 0.0 111.025 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.7 174.55 2.55 Favored Pre-proline 0 CA--C 1.589 2.452 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 165.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -72.92 157.08 51.95 Favored 'Trans proline' 0 CA--C 1.589 3.238 0 N-CA-C 121.782 3.724 . . . . 0.0 121.782 -174.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -72.21 135.01 24.04 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 C-N-CA 123.278 2.652 . . . . 0.0 113.123 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.7 27.77 45.45 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 118.821 2.289 . . . . 0.0 118.821 -165.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.28 23.1 m95 -111.3 162.53 14.91 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 120.004 1.902 . . . . 0.0 114.083 170.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.71 -155.15 0.59 Allowed 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 122.193 0.997 . . . . 0.0 112.505 149.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.33 120.37 10.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.913 -1.117 . . . . 0.0 111.567 -159.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.1 mtt-85 -136.66 115.74 12.43 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.24 -1.537 . . . . 0.0 113.338 -160.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.7 mtp -108.89 107.05 17.29 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -158.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.285 5.8 p 65.93 -163.1 0.25 Allowed 'General case' 0 CA--C 1.579 2.076 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 164.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -124.87 -75.18 0.6 Allowed 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.4 p -139.63 85.95 2.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 144.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 21.0 m -155.7 -27.69 0.1 Allowed 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 -158.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.19 44.32 7.61 Favored Glycine 0 N--CA 1.499 2.847 0 CA-C-N 121.213 1.824 . . . . 0.0 115.638 -170.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -137.57 172.5 12.87 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.494 1.118 . . . . 0.0 111.157 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.535 2.2 t 71.82 141.44 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.58 2.122 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 160.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.279 3.0 p90 -170.39 10.48 0.02 OUTLIER 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 -171.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -148.86 145.52 27.52 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 123.183 2.719 . . . . 0.0 113.602 -176.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -151.7 127.2 10.05 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.899 -1.126 . . . . 0.0 111.135 177.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.6 126.66 40.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.216 -1.552 . . . . 0.0 111.003 170.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -79.14 -45.79 19.28 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mt -66.81 -51.78 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 124.302 1.041 . . . . 0.0 112.96 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 85.7 m -56.65 -46.13 81.22 Favored 'General case' 0 CA--C 1.577 2.018 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 163.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.523 0.0 OUTLIER 76.21 65.98 0.06 Allowed 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 125.462 1.505 . . . . 0.0 112.302 -163.72 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -125.09 122.7 37.95 Favored 'General case' 0 CA--C 1.557 1.222 0 O-C-N 121.185 -0.947 . . . . 0.0 110.418 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -99.69 121.43 41.22 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.973 -0.455 . . . . 0.0 110.937 167.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -153.51 171.1 19.24 Favored 'General case' 0 CA--C 1.562 1.407 0 CA-C-O 123.364 1.554 . . . . 0.0 113.21 -164.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.314 0.6 OUTLIER -127.11 51.1 1.91 Allowed 'General case' 0 CA--C 1.567 1.601 0 O-C-N 121.12 -0.988 . . . . 0.0 113.251 166.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -135.93 140.15 43.8 Favored 'General case' 0 CA--C 1.56 1.353 0 CA-C-O 122.238 1.018 . . . . 0.0 110.593 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 52.8 ttp85 -81.26 128.12 71.51 Favored Pre-proline 0 CA--C 1.576 1.961 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.83 171.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -61.25 6.5 0.14 Allowed 'Trans proline' 0 CA--C 1.581 2.843 0 N-CA-C 120.03 3.05 . . . . 0.0 120.03 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.384 37.7 p 78.77 -63.31 0.29 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -175.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.33 -73.47 0.51 Allowed Glycine 0 N--CA 1.493 2.442 0 CA-C-N 118.697 0.681 . . . . 0.0 113.573 -165.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -90.87 86.42 6.3 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.502 0.668 . . . . 0.0 110.274 171.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 44.1 t -84.99 65.38 9.21 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 79.8 p -90.47 104.88 17.41 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 122.39 1.09 . . . . 0.0 112.486 171.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 70.4 m -112.71 -58.83 2.09 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.433 -1.712 . . . . 0.0 112.484 174.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.55 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 176.234 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.5 tttp . . . . . 0 N--CA 1.497 1.888 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . 0.523 28.6 m 56.52 -95.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 CA-C-N 119.194 0.907 . . . . 0.0 112.211 -154.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . 0.373 82.2 p 70.14 -42.4 0.51 Allowed 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 120.844 3.646 . . . . 0.0 120.844 155.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 75.3 t -83.29 98.37 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 CA-C-N 120.61 1.55 . . . . 0.0 109.76 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.8 t -77.05 116.58 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 CA-C-O 122.036 0.922 . . . . 0.0 109.004 177.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 16.2 mtp-105 -97.16 145.44 26.02 Favored 'General case' 0 CA--C 1.568 1.636 0 CA-C-O 122.322 1.058 . . . . 0.0 113.782 -171.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.277 24.3 Cg_endo -62.12 -52.53 2.67 Favored 'Trans proline' 0 CA--C 1.575 2.566 0 C-N-CA 123.053 2.502 . . . . 0.0 117.265 -171.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.83 -103.26 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.666 0 CA-C-N 125.086 2.852 . . . . 0.0 112.267 162.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.408 ' HZ1' ' C ' ' A' ' 13' ' ' SER . 12.0 ptmm? -161.47 171.02 18.87 Favored 'General case' 0 CA--C 1.577 1.994 0 CA-C-N 119.613 1.097 . . . . 0.0 112.014 167.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 76.2 p -49.99 155.94 1.45 Allowed Pre-proline 0 CA--C 1.582 2.203 0 N-CA-C 117.015 2.228 . . . . 0.0 117.015 157.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -60.05 -54.23 2.46 Favored 'Trans proline' 0 CA--C 1.572 2.383 0 CA-C-N 123.484 2.28 . . . . 0.0 115.915 173.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.408 ' C ' ' HZ1' ' A' ' 10' ' ' LYS . 80.2 p . . . . . 0 N--CA 1.486 1.368 0 C-N-CA 123.208 0.603 . . . . 0.0 112.122 158.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 10.5 pttp . . . . . 0 CA--C 1.576 1.956 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.3 171.07 10.52 Favored Pre-proline 0 CA--C 1.589 2.469 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 163.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -73.31 154.83 51.41 Favored 'Trans proline' 0 CA--C 1.59 3.306 0 N-CA-C 122.118 3.853 . . . . 0.0 122.118 -172.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -71.62 129.41 15.61 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.96 2.44 . . . . 0.0 113.009 173.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.64 7.84 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 117.322 1.689 . . . . 0.0 117.322 -160.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -123.4 169.87 10.92 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-N 120.362 2.081 . . . . 0.0 116.477 171.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.07 178.81 8.39 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-O 124.12 1.914 . . . . 0.0 111.836 144.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.271 0.2 OUTLIER -100.42 127.08 46.84 Favored 'General case' 0 CA--C 1.573 1.828 0 CA-C-N 114.135 -1.393 . . . . 0.0 112.406 169.188 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -129.61 126.19 37.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.228 -1.545 . . . . 0.0 109.699 -170.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 86.3 mmm -112.77 136.0 52.88 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -156.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.261 24.3 p 47.86 61.17 3.1 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 121.342 3.83 . . . . 0.0 121.342 137.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -71.31 -15.48 62.41 Favored 'General case' 0 CA--C 1.582 2.18 0 N-CA-C 117.325 2.343 . . . . 0.0 117.325 165.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -131.15 174.66 9.81 Favored 'General case' 0 CA--C 1.578 2.036 0 O-C-N 120.871 -1.143 . . . . 0.0 110.433 155.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 14.7 t -68.75 96.3 0.73 Allowed 'General case' 0 CA--C 1.57 1.729 0 N-CA-C 115.61 1.708 . . . . 0.0 115.61 -164.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.02 55.08 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 115.49 0.956 . . . . 0.0 115.49 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -141.19 163.73 32.18 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.12 0.968 . . . . 0.0 110.398 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.483 1.6 t 66.23 132.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.579 2.089 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 162.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.337 6.5 p90 -165.8 2.57 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.82 0 O-C-N 119.717 -1.864 . . . . 0.0 116.016 -171.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -144.01 156.77 44.52 Favored 'General case' 0 N--CA 1.502 2.148 0 CA-C-N 122.793 2.542 . . . . 0.0 114.142 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -161.75 129.75 4.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.294 -1.504 . . . . 0.0 109.441 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -83.65 125.61 32.03 Favored 'General case' 0 CA--C 1.576 1.943 0 O-C-N 120.106 -1.621 . . . . 0.0 110.645 168.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.75 -45.36 15.76 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 25.4 pt -67.12 -33.5 63.52 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 69.9 p -74.43 -49.59 21.84 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 114.773 1.398 . . . . 0.0 114.773 158.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.329 0.8 OUTLIER 82.6 58.83 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.996 0 C-N-CA 125.93 1.692 . . . . 0.0 112.592 -163.791 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -117.91 123.69 46.43 Favored 'General case' 0 CA--C 1.563 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 111.265 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 28.0 m -88.91 134.03 34.1 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.311 -0.868 . . . . 0.0 112.646 175.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -147.61 172.05 14.63 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 123.73 1.728 . . . . 0.0 113.424 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -121.92 60.62 0.97 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.314 -1.491 . . . . 0.0 110.358 163.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -156.77 130.18 8.07 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-O 121.977 0.894 . . . . 0.0 111.28 -152.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 -93.77 132.78 29.08 Favored Pre-proline 0 CA--C 1.573 1.852 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.168 -175.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -64.76 11.11 0.12 Allowed 'Trans proline' 0 CA--C 1.58 2.782 0 N-CA-C 119.499 2.846 . . . . 0.0 119.499 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.32 9.7 t 73.6 -70.58 0.15 Allowed 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.89 -67.04 0.78 Allowed Glycine 0 N--CA 1.492 2.388 0 O-C-N 121.729 -0.607 . . . . 0.0 113.957 -157.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -84.73 123.64 30.62 Favored 'General case' 0 CA--C 1.571 1.781 0 O-C-N 122.482 -0.423 . . . . 0.0 112.018 170.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 25.6 t -107.51 34.24 3.62 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 168.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 51.1 m -151.11 114.49 4.84 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 119.99 -1.694 . . . . 0.0 109.092 157.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -140.97 -75.26 0.32 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.831 178.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 N-CA-C 109.716 -1.354 . . . . 0.0 109.716 -138.586 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 97.5 mttt . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 118.605 -0.712 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.4 p -149.5 140.39 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 CA-C-N 119.664 1.12 . . . . 0.0 110.461 -178.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.8 m -88.97 94.35 9.92 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.297 -0.877 . . . . 0.0 111.046 168.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.253 12.3 p -76.78 85.08 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -170.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.258 13.6 t 71.49 119.08 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 C-N-CA 124.542 1.137 . . . . 0.0 110.063 -167.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -141.54 130.85 23.59 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.128 0.966 . . . . 0.0 112.607 -172.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TPO . . . . . 1.322 ' O3P' ' HB3' ' B' ' 16' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -63.33 -47.94 6.94 Favored 'Trans proline' 0 CA--C 1.575 2.555 0 C-N-CA 123.188 2.592 . . . . 0.0 118.804 -175.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.03 -63.68 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.282 0 CA-C-N 125.886 3.138 . . . . 0.0 115.532 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? -154.78 142.57 19.97 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.046 . . . . 0.0 112.127 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.8 m -56.07 143.99 60.86 Favored Pre-proline 0 CA--C 1.58 2.113 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 165.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . 0.351 0.3 OUTLIER 4.17 70.03 0.0 OUTLIER 'Trans proline' 0 CA--C 1.561 1.839 2 N-CA-C 123.911 4.543 . . . . 0.0 123.911 -148.609 . . . . . . . . 4 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.481 ' C ' HH21 ' B' ' 16' ' ' ARG . 37.7 t . . . . . 0 C--O 1.253 1.284 0 O-C-N 121.208 -0.933 . . . . 0.0 110.218 129.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 117.056 -1.45 . . . . 0.0 111.652 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.324 1.2 pp 47.82 175.76 0.01 OUTLIER Pre-proline 0 N--CA 1.51 2.559 0 N-CA-C 120.16 3.392 . . . . 0.0 120.16 175.906 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -78.94 158.05 27.3 Favored 'Trans proline' 0 CA--C 1.587 3.15 0 N-CA-C 122.126 3.856 . . . . 0.0 122.126 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.74 127.02 8.48 Favored 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 123.271 2.648 . . . . 0.0 113.133 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.21 23.82 16.14 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 118.095 1.998 . . . . 0.0 118.095 -163.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.283 22.1 m95 -119.52 169.28 10.19 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 120.87 2.335 . . . . 0.0 115.848 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -134.71 164.88 26.54 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 124.957 2.313 . . . . 0.0 113.731 151.156 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.33 123.89 30.08 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-N 112.783 -2.008 . . . . 0.0 110.177 142.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 -122.77 102.38 8.0 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 121.684 2.038 . . . . 0.0 110.599 -173.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.43 115.18 29.7 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -155.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 26.5 p 67.7 131.29 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.611 2.449 . . . . 0.0 117.611 168.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.61 -68.92 0.56 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.587 -1.321 . . . . 0.0 107.643 160.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 88.8 p -93.88 111.16 22.82 Favored 'General case' 0 CA--C 1.572 1.815 0 O-C-N 120.819 -1.175 . . . . 0.0 112.706 166.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . 0.278 38.8 p 63.88 40.27 7.57 Favored 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 119.885 3.291 . . . . 0.0 119.885 169.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.73 33.11 38.86 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 117.244 1.658 . . . . 0.0 117.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . 1.322 ' HB3' ' O3P' ' A' ' 7' ' ' TPO . 9.4 mpt_? -116.96 126.08 52.39 Favored 'General case' 0 CA--C 1.565 1.552 0 CA-C-N 118.487 1.143 . . . . 0.0 111.236 -171.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.846 0.7 OUTLIER 110.4 148.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.417 1.887 . . . . 0.0 114.565 -179.131 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.394 10.2 p90 -170.46 12.23 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.252 0 C-N-CA 126.272 1.829 . . . . 0.0 115.383 176.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -148.47 137.67 21.84 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 122.364 2.347 . . . . 0.0 111.986 165.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -143.02 135.45 27.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.637 -1.914 . . . . 0.0 110.844 173.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.22 120.55 31.47 Favored 'General case' 0 CA--C 1.57 1.739 0 O-C-N 120.203 -1.561 . . . . 0.0 110.536 169.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -76.7 -43.97 35.47 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 26.5 pt -71.64 -35.98 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 80.4 p -71.36 -50.76 29.0 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 159.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.317 34.7 t-20 83.72 64.74 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 126.115 1.766 . . . . 0.0 112.162 -163.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -128.49 118.75 23.6 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 123.514 0.726 . . . . 0.0 111.455 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 89.6 p -86.42 128.23 34.92 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -0.964 . . . . 0.0 113.301 171.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -137.72 177.8 7.59 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.031 1.396 . . . . 0.0 111.887 175.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.366 0.1 OUTLIER -128.74 47.09 2.5 Favored 'General case' 0 CA--C 1.571 1.785 0 O-C-N 119.794 -1.816 . . . . 0.0 114.097 164.092 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -147.56 160.38 42.7 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-O 125.329 2.49 . . . . 0.0 109.587 167.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.313 17.7 ttp-105 -64.53 155.87 79.56 Favored Pre-proline 0 CA--C 1.569 1.709 0 CA-C-N 112.842 -1.981 . . . . 0.0 116.239 171.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.21 65.7 1.46 Allowed 'Trans proline' 0 CA--C 1.573 2.429 0 C-N-CA 122.233 1.955 . . . . 0.0 112.258 154.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 58.4 m -53.02 -13.36 0.44 Allowed 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 119.841 3.275 . . . . 0.0 119.841 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -95.22 57.74 1.72 Allowed Glycine 0 N--CA 1.494 2.507 0 CA-C-N 119.387 0.994 . . . . 0.0 115.255 171.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -134.24 98.63 4.16 Favored 'General case' 0 CA--C 1.566 1.562 0 C-N-CA 123.058 0.543 . . . . 0.0 110.098 -172.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 22.7 t -79.59 161.29 26.02 Favored 'General case' 0 CA--C 1.571 1.772 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 176.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 64.9 m -89.8 62.44 5.74 Favored 'General case' 0 N--CA 1.503 2.211 0 CA-C-O 124.525 2.107 . . . . 0.0 114.243 169.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 80.3 p -171.92 -42.7 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 112.554 -2.112 . . . . 0.0 115.03 -162.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 N-CA-C 107.857 -2.097 . . . . 0.0 107.857 -133.204 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.2 tptp . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 118.882 -0.58 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.5 t -136.72 52.4 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 CA-C-N 119.692 1.133 . . . . 0.0 109.84 167.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.8 t -174.06 155.37 2.48 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.024 -1.672 . . . . 0.0 112.201 -174.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.318 3.3 t 75.75 127.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.349 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 162.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.0 t -116.86 128.41 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 C-N-CA 124.123 0.969 . . . . 0.0 109.075 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -135.65 159.43 41.64 Favored 'General case' 0 N--CA 1.504 2.266 0 N-CA-C 117.507 2.41 . . . . 0.0 117.507 -160.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TPO . . . . . 0.558 ' O2P' ' O ' ' A' ' 13' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -70.14 -63.53 0.04 OUTLIER 'Trans proline' 0 CA--C 1.578 2.698 0 C-N-CA 123.099 2.532 . . . . 0.0 117.497 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -72.86 92.5 0.79 Allowed 'Trans proline' 0 CA--C 1.566 2.082 0 CA-C-N 125.566 3.023 . . . . 0.0 111.589 171.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.71 104.02 0.1 Allowed 'General case' 0 CA--C 1.571 1.759 0 CA-C-N 113.519 -1.673 . . . . 0.0 114.664 -165.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.4 m -83.51 177.56 2.93 Favored Pre-proline 0 CA--C 1.581 2.157 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -168.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -54.66 -13.99 6.73 Favored 'Trans proline' 0 CA--C 1.577 2.63 0 N-CA-C 119.908 3.003 . . . . 0.0 119.908 167.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.558 ' O ' ' O2P' ' A' ' 7' ' ' TPO . 58.1 m . . . . . 0 N--CA 1.485 1.304 0 O-C-N 120.704 -1.248 . . . . 0.0 109.98 161.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? . . . . . 0 CA--C 1.572 1.814 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.87 169.17 10.23 Favored Pre-proline 0 CA--C 1.588 2.42 0 N-CA-C 116.363 1.986 . . . . 0.0 116.363 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -70.88 153.61 63.7 Favored 'Trans proline' 0 CA--C 1.588 3.191 0 N-CA-C 122.157 3.868 . . . . 0.0 122.157 -172.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.21 126.74 10.68 Favored 'Trans proline' 0 CA--C 1.566 2.096 0 C-N-CA 123.183 2.589 . . . . 0.0 112.664 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.89 28.36 10.17 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 -161.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.254 12.6 m95 -114.54 162.96 16.04 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.276 2.038 . . . . 0.0 114.072 171.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -153.92 141.38 19.74 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-O 123.285 1.517 . . . . 0.0 114.916 152.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.44 128.17 35.82 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 166.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -129.59 106.88 9.04 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-N 120.494 1.497 . . . . 0.0 111.441 -174.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 3.2 ttm -114.82 129.3 56.67 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -132.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.344 24.5 p 78.42 157.85 0.17 Allowed 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 154.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . 0.429 HH22 ' C ' ' A' ' 13' ' ' SER . 1.6 ptm180 -151.42 -50.55 0.12 Allowed 'General case' 0 CA--C 1.57 1.748 0 C-N-CA 124.524 1.13 . . . . 0.0 112.318 176.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 93.2 p -100.16 -61.89 1.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.0 112.786 157.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 97.3 p -119.15 -59.49 1.84 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -163.52 45.28 0.32 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 116.863 1.505 . . . . 0.0 116.863 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.12 144.32 44.3 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.548 1.139 . . . . 0.0 113.303 169.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.731 0.5 OUTLIER 73.45 124.84 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 CA-C-N 115.274 -0.875 . . . . 0.0 112.416 -142.68 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.308 9.8 p90 -172.29 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.16 0 CA-C-O 116.08 -1.914 . . . . 0.0 114.841 -174.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -153.85 148.79 26.66 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 124.357 3.253 . . . . 0.0 115.591 174.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -161.48 136.55 7.44 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 125.903 1.681 . . . . 0.0 109.123 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.12 128.47 44.07 Favored 'General case' 0 CA--C 1.571 1.752 0 O-C-N 120.27 -1.519 . . . . 0.0 110.642 172.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -75.16 -55.83 5.33 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.162 -1.586 . . . . 0.0 114.163 174.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -60.64 -35.16 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.36 -17.42 23.57 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 164.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.326 3.0 t-20 64.59 24.44 13.02 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 -164.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.54 150.73 43.27 Favored 'General case' 0 CA--C 1.573 1.863 0 O-C-N 119.599 -1.938 . . . . 0.0 114.273 164.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.4 m -152.56 122.09 6.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.964 -1.71 . . . . 0.0 111.2 -170.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -162.55 177.08 9.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 124.051 1.882 . . . . 0.0 112.952 -150.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.273 0.1 OUTLIER -119.01 39.44 3.54 Favored 'General case' 0 CA--C 1.577 1.995 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.824 155.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -127.13 134.14 50.25 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 122.394 1.093 . . . . 0.0 110.396 -167.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -90.56 123.97 63.84 Favored Pre-proline 0 CA--C 1.574 1.903 0 CA-C-O 117.897 -1.049 . . . . 0.0 113.512 -172.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -60.02 -39.83 66.89 Favored 'Trans proline' 0 CA--C 1.569 2.261 0 N-CA-C 117.845 2.21 . . . . 0.0 117.845 171.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.34 1.2 m 86.18 -49.81 0.06 Allowed 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 125.134 1.374 . . . . 0.0 114.606 -165.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.95 -75.06 2.43 Favored Glycine 0 N--CA 1.495 2.601 0 N-CA-C 116.576 1.39 . . . . 0.0 116.576 -177.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -75.8 -13.02 60.28 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 118.086 2.625 . . . . 0.0 118.086 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . 0.266 10.9 t 58.8 23.1 10.86 Favored 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 119.132 3.012 . . . . 0.0 119.132 -174.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 52.5 m -152.46 112.45 4.0 Favored 'General case' 0 CA--C 1.562 1.404 0 O-C-N 120.453 -1.404 . . . . 0.0 107.934 160.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 85.7 p -163.0 -52.36 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 114.265 -1.334 . . . . 0.0 113.891 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -141.362 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 118.85 -0.595 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -76.46 140.16 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.22 0 CA-C-N 120.0 1.273 . . . . 0.0 113.734 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m -106.37 77.86 1.24 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 120.685 -1.259 . . . . 0.0 111.191 167.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.7 p -80.85 105.03 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.892 0 C-N-CA 123.737 0.815 . . . . 0.0 111.883 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.333 2.4 t 73.6 111.86 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 C-N-CA 124.338 1.055 . . . . 0.0 110.906 -173.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.264 24.2 ptt-85 -146.43 -166.2 2.42 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 119.878 -1.763 . . . . 0.0 115.759 -156.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.293 18.1 Cg_endo -71.62 -68.53 0.02 OUTLIER 'Trans proline' 0 CA--C 1.582 2.912 0 N-CA-C 119.548 2.865 . . . . 0.0 119.548 -175.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -70.37 -49.31 0.48 Allowed 'Trans proline' 0 CA--C 1.567 2.127 0 CA-C-N 126.187 3.245 . . . . 0.0 117.487 -174.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.42 162.17 41.31 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.912 -1.118 . . . . 0.0 111.912 165.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.5 t -36.69 149.06 0.17 Allowed Pre-proline 0 CA--C 1.594 2.654 0 N-CA-C 120.851 3.649 . . . . 0.0 120.851 178.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -66.73 -33.71 33.9 Favored 'Trans proline' 0 CA--C 1.57 2.298 0 C-N-CA 123.441 2.761 . . . . 0.0 117.256 173.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.8 m . . . . . 0 N--CA 1.488 1.433 0 O-C-N 121.618 -0.676 . . . . 0.0 110.254 150.49 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 20.4 tptm . . . . . 0 CA--C 1.577 2.006 0 CA-C-O 120.941 0.401 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -144.59 176.28 2.33 Favored Pre-proline 0 CA--C 1.587 2.38 0 C-N-CA 124.471 1.109 . . . . 0.0 109.485 164.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -76.13 157.32 38.07 Favored 'Trans proline' 0 CA--C 1.584 3.016 0 N-CA-C 121.21 3.504 . . . . 0.0 121.21 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -79.19 124.33 5.95 Favored 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.117 2.545 . . . . 0.0 112.879 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.39 30.7 9.62 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 117.944 1.937 . . . . 0.0 117.944 -164.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . 0.429 ' CZ2' ' HG3' ' B' ' 32' ' ' PRO 0.268 22.4 m95 -114.13 162.82 16.02 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.506 1.653 . . . . 0.0 114.102 170.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -147.75 -148.62 0.26 Allowed 'General case' 0 CA--C 1.573 1.83 0 CA-C-O 121.93 0.871 . . . . 0.0 112.468 149.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.77 118.24 9.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.76 -1.212 . . . . 0.0 111.157 -161.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 mtt-85 -140.75 121.72 14.58 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.184 -1.573 . . . . 0.0 112.075 -161.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.5 mtp -113.18 142.33 45.9 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 118.355 2.724 . . . . 0.0 118.355 -150.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.301 46.7 m 65.57 62.11 0.67 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 118.495 2.776 . . . . 0.0 118.495 155.611 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . 0.422 ' H ' HG12 ' B' ' 17' ' ' VAL . 16.0 mtp180 -65.75 -29.26 69.75 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 156.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 74.9 m -133.63 136.78 45.04 Favored 'General case' 0 CA--C 1.563 1.469 0 O-C-N 120.477 -1.39 . . . . 0.0 108.588 156.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 49.9 m -35.23 102.26 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 119.068 2.988 . . . . 0.0 119.068 -165.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 99.18 -0.4 57.27 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 119.047 2.379 . . . . 0.0 119.047 -173.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? -127.59 128.15 45.08 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 120.484 2.142 . . . . 0.0 112.371 -166.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . 0.422 HG12 ' H ' ' B' ' 12' ' ' ARG 0.82 0.3 OUTLIER 99.46 135.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 C-N-CA 125.892 1.677 . . . . 0.0 112.217 -160.199 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.3 2.5 p90 -173.74 9.49 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.325 0 C-N-CA 126.184 1.794 . . . . 0.0 115.712 -170.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -147.27 144.92 29.19 Favored 'General case' 0 N--CA 1.511 2.603 0 CA-C-N 122.673 2.488 . . . . 0.0 112.982 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -152.89 129.79 10.98 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.137 -1.602 . . . . 0.0 112.666 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.71 125.04 37.15 Favored 'General case' 0 CA--C 1.573 1.831 0 O-C-N 120.197 -1.564 . . . . 0.0 111.063 168.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 -68.6 -42.5 78.07 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 9.0 mt -71.4 -54.84 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.166 0.986 . . . . 0.0 112.763 -171.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' THR . . . . . 0.451 HG23 ' H ' ' B' ' 26' ' ' ALA . 9.1 t -81.33 -15.98 53.74 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 171.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.285 6.4 t-20 61.9 17.47 8.94 Favored 'General case' 0 CA--C 1.582 2.193 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 -160.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . 0.451 ' H ' HG23 ' B' ' 24' ' ' THR . . . -58.9 96.85 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 O-C-N 119.874 -1.766 . . . . 0.0 113.29 162.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 9.3 m -113.59 122.75 48.15 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -170.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.86 163.69 38.91 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 124.154 1.931 . . . . 0.0 115.074 -154.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -102.42 49.12 0.85 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 113.846 -1.524 . . . . 0.0 112.378 168.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -161.04 138.77 9.33 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 123.092 1.425 . . . . 0.0 111.045 -148.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 68.8 ttt-85 -107.33 112.54 62.67 Favored Pre-proline 0 CA--C 1.573 1.839 0 CA-C-O 117.772 -1.109 . . . . 0.0 112.884 -155.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . 0.429 ' HG3' ' CZ2' ' B' ' 6' ' ' TRP . 39.2 Cg_endo -68.36 -48.5 1.17 Allowed 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 122.408 2.072 . . . . 0.0 115.335 174.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t 69.31 -47.97 0.59 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 118.828 2.899 . . . . 0.0 118.828 177.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.24 -53.01 4.4 Favored Glycine 0 N--CA 1.495 2.604 0 O-C-N 120.715 -1.241 . . . . 0.0 115.848 -164.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -123.35 132.2 53.9 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 161.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . 0.343 45.5 m 124.87 -68.23 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.426 0 C-N-CA 127.554 2.342 . . . . 0.0 110.896 -168.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 38.2 m -87.57 61.58 6.61 Favored 'General case' 0 N--CA 1.504 2.261 0 CA-C-O 124.508 2.099 . . . . 0.0 113.068 176.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 15.1 t 170.23 -60.91 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.72 -2.036 . . . . 0.0 110.326 -145.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 107.387 -2.285 . . . . 0.0 107.387 -131.909 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? . . . . . 0 CA--C 1.576 1.979 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 84.1 t -83.82 140.33 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 CA-C-O 122.161 0.982 . . . . 0.0 112.306 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.0 t -132.61 85.42 2.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.005 -1.059 . . . . 0.0 108.782 160.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.296 22.3 t 73.05 141.35 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 C-N-CA 124.381 1.073 . . . . 0.0 111.578 -164.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.6 t -82.8 80.59 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.305 0 O-C-N 119.517 -1.989 . . . . 0.0 110.132 170.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.14 170.06 9.39 Favored 'General case' 0 CA--C 1.574 1.888 0 CA-C-N 113.435 -1.711 . . . . 0.0 115.099 -172.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.253 6.3 Cg_exo -64.6 -59.18 0.18 Allowed 'Trans proline' 0 CA--C 1.573 2.442 0 C-N-CA 123.325 2.684 . . . . 0.0 118.524 169.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -80.25 -111.61 0.01 OUTLIER 'Trans proline' 0 CA--C 1.572 2.397 0 CA-C-N 125.343 2.944 . . . . 0.0 112.507 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.39 102.77 3.63 Favored 'General case' 0 CA--C 1.568 1.648 0 O-C-N 120.317 -1.489 . . . . 0.0 110.388 172.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.256 89.3 p -35.51 168.65 0.02 OUTLIER Pre-proline 0 CA--C 1.587 2.373 0 N-CA-C 119.001 2.963 . . . . 0.0 119.001 113.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -56.98 -63.28 0.17 Allowed 'Trans proline' 0 CA--C 1.578 2.682 0 CA-C-N 123.925 2.438 . . . . 0.0 114.499 158.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.459 ' C ' HH12 ' B' ' 12' ' ' ARG . 32.3 t . . . . . 0 N--CA 1.487 1.376 0 C-N-CA 123.829 0.851 . . . . 0.0 112.314 170.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? . . . . . 0 CA--C 1.57 1.736 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -63.08 170.82 2.35 Favored Pre-proline 0 CA--C 1.586 2.364 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . 0.25 33.6 Cg_exo -68.1 155.6 68.93 Favored 'Trans proline' 0 CA--C 1.593 3.44 0 N-CA-C 122.45 3.981 . . . . 0.0 122.45 -172.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -73.41 135.73 22.79 Favored 'Trans proline' 0 CA--C 1.563 1.975 0 C-N-CA 123.311 2.674 . . . . 0.0 112.694 175.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.06 32.15 26.91 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 -161.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.261 17.1 m95 -116.68 162.44 17.65 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 120.589 2.195 . . . . 0.0 114.521 170.209 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.95 -148.1 0.24 Allowed 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.966 0.889 . . . . 0.0 111.671 150.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -149.49 118.93 6.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.227 -1.546 . . . . 0.0 110.415 -163.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -137.93 115.48 11.26 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.098 -1.626 . . . . 0.0 114.449 -161.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -101.11 114.04 27.62 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -152.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 78.9 p 46.7 87.33 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 119.998 3.332 . . . . 0.0 119.998 169.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . 0.459 HH12 ' C ' ' A' ' 13' ' ' SER 0.256 0.0 OUTLIER -56.03 -40.49 73.53 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 173.005 . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 84.9 p -160.6 55.49 0.32 Allowed 'General case' 0 CA--C 1.576 1.974 0 C-N-CA 124.283 1.033 . . . . 0.0 111.584 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -164.82 -114.34 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.399 -1.438 . . . . 0.0 109.809 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -161.33 26.69 0.27 Allowed Glycine 0 N--CA 1.498 2.816 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 172.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -138.47 170.7 15.56 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 125.019 1.327 . . . . 0.0 109.408 171.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.809 0.3 OUTLIER 93.31 131.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 120.774 -1.204 . . . . 0.0 111.723 -156.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.339 1.4 p90 -177.83 8.73 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.477 0 C-N-CA 126.084 1.754 . . . . 0.0 114.606 -167.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -136.12 137.44 41.01 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 119.185 -2.197 . . . . 0.0 109.373 174.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -140.12 130.28 25.04 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 119.509 -1.994 . . . . 0.0 112.922 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.63 129.7 39.81 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.091 -1.631 . . . . 0.0 111.149 171.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -82.69 -53.56 5.82 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 175.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 31.1 pt -62.94 -50.0 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 94.5 m -58.17 -42.3 85.71 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 158.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.314 11.5 t-20 77.5 73.02 0.06 Allowed 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 125.763 1.625 . . . . 0.0 109.433 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -152.0 134.56 15.38 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.535 -0.728 . . . . 0.0 111.811 -169.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 92.5 p -86.62 131.7 34.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.023 -1.048 . . . . 0.0 112.555 161.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.274 1.3 pt20 -133.68 161.72 33.89 Favored 'General case' 0 CA--C 1.566 1.571 0 CA-C-O 122.573 1.177 . . . . 0.0 112.682 167.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.276 0.1 OUTLIER -108.87 19.61 19.42 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 170.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -157.56 38.89 0.28 Allowed 'General case' 0 CA--C 1.567 1.607 0 N-CA-C 119.869 3.285 . . . . 0.0 119.869 -171.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 54.28 142.67 0.03 OUTLIER Pre-proline 0 CA--C 1.59 2.493 0 N-CA-C 121.393 3.849 . . . . 0.0 121.393 166.379 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -69.45 3.24 2.74 Favored 'Trans proline' 0 CA--C 1.578 2.684 0 N-CA-C 118.36 2.408 . . . . 0.0 118.36 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.358 8.6 m 78.07 -47.72 0.46 Allowed 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 -172.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.9 80.28 0.35 Allowed Glycine 0 N--CA 1.5 2.957 0 CA-C-N 120.411 1.46 . . . . 0.0 116.014 176.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -132.04 -44.66 0.95 Allowed 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -166.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 11.1 t -73.61 -10.55 59.82 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 119.002 2.964 . . . . 0.0 119.002 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 44.4 p -71.14 114.81 9.58 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 121.241 1.837 . . . . 0.0 111.408 158.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 3.7 t -144.17 -83.3 0.15 Allowed 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 114.906 -1.043 . . . . 0.0 111.081 -164.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.6 0 C-N-CA 118.04 -2.029 . . . . 0.0 110.101 -119.387 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.499 1.985 0 CA-C-O 121.971 0.891 . . . . 0.0 109.081 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 122.598 1.19 . . . . 0.0 113.555 -172.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.294 9.7 Cg_endo . . . . . 0 CA--C 1.578 2.694 0 N-CA-C 117.89 2.227 . . . . 0.0 117.89 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -83.06 -117.62 0.01 OUTLIER 'Trans proline' 0 CA--C 1.582 2.915 0 CA-C-N 123.987 2.46 . . . . 0.0 111.885 162.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.4 pttp . . . . . 0 CA--C 1.576 1.95 0 O-C-N 120.202 -1.561 . . . . 0.0 111.244 164.876 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 CA--C 1.581 2.162 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pp -74.71 171.66 10.94 Favored Pre-proline 0 CA--C 1.589 2.477 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -72.79 156.27 53.11 Favored 'Trans proline' 0 CA--C 1.586 3.107 0 N-CA-C 121.958 3.792 . . . . 0.0 121.958 -174.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.28 129.26 15.72 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 C-N-CA 123.029 2.486 . . . . 0.0 113.605 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.95 28.82 24.87 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 118.578 2.191 . . . . 0.0 118.578 -167.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.251 16.5 m95 -109.76 177.09 4.83 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 120.241 2.021 . . . . 0.0 116.352 173.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -148.56 162.36 39.81 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-O 124.122 1.915 . . . . 0.0 111.081 147.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.254 0.1 OUTLIER -101.14 116.75 33.54 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.541 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -101.05 160.23 14.55 Favored 'General case' 0 CA--C 1.557 1.224 0 O-C-N 120.093 -1.63 . . . . 0.0 107.98 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.18 125.04 13.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -173.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.292 20.7 p 74.99 146.63 0.09 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 119.047 2.98 . . . . 0.0 119.047 157.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 39.8 mtm-85 -130.0 -68.64 0.7 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.91 -1.119 . . . . 0.0 110.11 162.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 96.2 p -115.68 -70.65 0.78 Allowed 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 119.194 0.907 . . . . 0.0 111.941 170.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 34.0 t -72.18 1.98 6.66 Favored 'General case' 0 CA--C 1.579 2.096 0 N-CA-C 119.227 3.047 . . . . 0.0 119.227 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.66 54.61 1.91 Allowed Glycine 0 N--CA 1.489 2.169 0 CA-C-N 120.704 1.593 . . . . 0.0 113.628 -177.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -136.29 137.77 41.05 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 123.207 1.479 . . . . 0.0 113.676 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.434 HG22 ' H ' ' B' ' 18' ' ' TYR 0.802 1.1 p 135.1 148.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 C-N-CA 129.239 3.016 . . . . 0.0 111.642 177.723 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.434 ' H ' HG22 ' B' ' 17' ' ' VAL 0.345 52.4 m-85 -135.95 -48.2 0.67 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -159.05 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -155.38 146.82 22.91 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 123.11 1.433 . . . . 0.0 113.615 -160.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -151.42 122.53 7.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.512 -1.367 . . . . 0.0 108.55 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.35 124.24 27.6 Favored 'General case' 0 CA--C 1.57 1.744 0 O-C-N 119.736 -1.852 . . . . 0.0 110.833 174.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.33 -46.82 11.37 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -175.349 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.5 pt -61.82 -45.09 99.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.281 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 172.595 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 55.3 m -66.58 -48.11 70.63 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 165.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.343 53.4 m-80 77.97 68.41 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.673 0 C-N-CA 126.499 1.92 . . . . 0.0 112.656 -166.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -137.71 124.5 21.16 Favored 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.777 0.831 . . . . 0.0 110.739 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 37.4 m -83.39 142.26 31.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.377 -0.827 . . . . 0.0 112.892 172.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.27 10.1 pt20 -148.17 173.42 12.99 Favored 'General case' 0 CA--C 1.562 1.426 0 CA-C-O 123.58 1.657 . . . . 0.0 113.305 166.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.305 0.1 OUTLIER -111.33 39.69 2.25 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 169.297 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.11 160.1 40.71 Favored 'General case' 0 CA--C 1.563 1.472 0 CA-C-O 123.728 1.727 . . . . 0.0 111.228 174.235 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.25 15.2 ttt85 -54.2 157.49 4.56 Favored Pre-proline 0 CA--C 1.585 2.314 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 159.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -60.52 17.9 0.04 OUTLIER 'Trans proline' 0 CA--C 1.584 3.02 0 N-CA-C 119.173 2.72 . . . . 0.0 119.173 164.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.322 8.4 t . . . . . 0 N--CA 1.492 1.674 0 C-N-CA 125.538 1.535 . . . . 0.0 114.253 -172.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.302 3.4 t . . . . . 0 N--CA 1.503 2.199 0 CA-C-O 122.147 0.975 . . . . 0.0 109.797 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 35.0 ttp85 . . . . . 0 N--CA 1.496 1.835 0 O-C-N 120.969 -1.082 . . . . 0.0 113.471 -168.631 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.282 13.4 Cg_endo . . . . . 0 CA--C 1.585 3.052 0 N-CA-C 116.805 1.81 . . . . 0.0 116.805 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -80.06 -111.37 0.01 OUTLIER 'Trans proline' 0 CA--C 1.578 2.704 0 CA-C-N 125.018 2.828 . . . . 0.0 112.942 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.0 pttt . . . . . 0 CA--C 1.573 1.841 0 O-C-N 120.546 -1.347 . . . . 0.0 112.194 167.732 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.584 2.255 0 N-CA-C 118.071 2.619 . . . . 0.0 118.071 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.372 0.6 OUTLIER 50.41 163.62 0.04 OUTLIER Pre-proline 0 CA--C 1.59 2.481 0 N-CA-C 118.205 2.668 . . . . 0.0 118.205 -157.313 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -77.72 156.02 31.34 Favored 'Trans proline' 0 CA--C 1.591 3.366 0 N-CA-C 121.927 3.78 . . . . 0.0 121.927 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.34 130.54 15.23 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.135 2.556 . . . . 0.0 112.648 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.72 25.74 17.04 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 118.017 1.967 . . . . 0.0 118.017 -161.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.276 26.5 m95 -117.61 171.46 8.01 Favored 'General case' 0 CA--C 1.561 1.398 0 CA-C-N 120.387 2.094 . . . . 0.0 115.856 172.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -157.55 137.18 12.16 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 122.454 1.121 . . . . 0.0 113.187 147.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.67 127.53 32.76 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 174.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 14.8 mtt-85 -137.07 111.62 8.65 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.996 -1.69 . . . . 0.0 110.737 -167.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 28.7 mtp -114.6 141.76 47.34 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 116.906 2.188 . . . . 0.0 116.906 -138.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.266 54.3 p 60.68 64.99 1.09 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 137.228 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 62.1 mtm180 -88.63 -12.18 43.25 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 68.9 m -144.64 -112.29 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.483 -1.386 . . . . 0.0 108.255 166.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 48.2 m -86.48 56.56 4.05 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 121.45 1.932 . . . . 0.0 115.176 -175.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.5 53.3 6.07 Favored Glycine 0 N--CA 1.489 2.174 0 O-C-N 120.514 -1.366 . . . . 0.0 114.719 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -132.8 144.47 50.26 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 122.259 1.028 . . . . 0.0 112.191 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.678 0.5 OUTLIER 73.27 135.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -159.113 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.351 1.9 p90 -175.02 7.07 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.311 0 C-N-CA 126.281 1.833 . . . . 0.0 114.905 -169.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -146.49 148.11 31.89 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 122.42 2.373 . . . . 0.0 112.76 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -150.58 123.37 8.64 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.112 -1.617 . . . . 0.0 108.199 173.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.28 126.1 33.43 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 119.959 -1.713 . . . . 0.0 110.641 172.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -88.17 -46.68 9.06 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.297 1.962 . . . . 0.0 116.297 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 33.5 pt -58.93 -40.26 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 56.4 m -71.55 -45.48 62.21 Favored 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 160.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.327 6.2 t30 79.04 67.91 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 125.838 1.655 . . . . 0.0 112.366 -169.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -142.38 122.65 13.88 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.391 0.676 . . . . 0.0 111.641 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 79.4 p -81.04 134.15 35.62 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -153.4 167.6 28.87 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.259 0.2 OUTLIER -113.3 36.92 3.35 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-N 113.622 -1.626 . . . . 0.0 114.986 169.937 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -148.14 157.4 43.48 Favored 'General case' 0 CA--C 1.571 1.767 0 CA-C-O 125.588 2.613 . . . . 0.0 111.408 167.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.341 18.7 ttp-105 -69.05 150.98 97.41 Favored Pre-proline 0 CA--C 1.58 2.13 0 CA-C-N 112.09 -2.323 . . . . 0.0 115.655 174.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.34 -35.92 98.89 Favored 'Trans proline' 0 CA--C 1.57 2.278 0 C-N-CA 122.614 2.209 . . . . 0.0 117.083 168.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.314 1.6 t . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 165.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.9 t . . . . . 0 N--CA 1.505 2.276 0 CA-C-O 125.401 2.524 . . . . 0.0 111.355 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.575 1.926 0 CA-C-N 111.276 -2.693 . . . . 0.0 115.354 -172.105 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.31 36.9 Cg_endo . . . . . 0 CA--C 1.586 3.094 0 CA-C-O 114.292 -2.462 . . . . 0.0 114.952 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -77.48 81.17 2.72 Favored 'Trans proline' 0 CA--C 1.57 2.312 0 CA-C-N 127.969 3.882 . . . . 0.0 112.809 173.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.57 1.728 0 N-CA-C 120.482 3.512 . . . . 0.0 120.482 -144.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 55.2 pttt . . . . . 0 CA--C 1.573 1.843 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 pp -115.35 175.59 1.84 Allowed Pre-proline 0 CA--C 1.588 2.409 0 CA-C-O 118.513 -0.756 . . . . 0.0 112.167 159.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -80.0 158.57 23.95 Favored 'Trans proline' 0 CA--C 1.59 3.299 0 N-CA-C 122.218 3.892 . . . . 0.0 122.218 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -78.47 129.87 9.62 Favored 'Trans proline' 0 CA--C 1.564 2.017 0 C-N-CA 123.233 2.622 . . . . 0.0 112.735 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.22 25.96 20.05 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 117.975 1.95 . . . . 0.0 117.975 -162.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.273 26.0 m95 -113.82 164.4 13.8 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-N 119.804 1.802 . . . . 0.0 114.662 172.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -145.17 -154.58 0.55 Allowed 'General case' 0 CA--C 1.569 1.708 0 CA-C-O 122.397 1.094 . . . . 0.0 112.219 147.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -145.28 119.61 9.59 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.816 -1.177 . . . . 0.0 111.293 -160.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -139.76 115.38 10.05 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.263 -1.523 . . . . 0.0 111.486 -161.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 26.8 mtp -114.32 142.07 46.79 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 117.985 2.587 . . . . 0.0 117.985 -139.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.323 55.9 p 71.59 75.83 0.17 Allowed 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 117.56 2.429 . . . . 0.0 117.56 151.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 24.8 mtp180 -102.48 -13.44 17.23 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 164.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 72.1 m -144.23 -157.03 0.75 Allowed 'General case' 0 CA--C 1.581 2.16 0 O-C-N 119.957 -1.715 . . . . 0.0 109.643 163.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 74.3 p -71.37 88.53 0.88 Allowed 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.328 -2.107 . . . . 0.0 115.105 -174.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.23 46.0 45.29 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 116.122 1.209 . . . . 0.0 116.122 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -134.2 122.74 23.22 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 117.975 0.887 . . . . 0.0 110.414 -163.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.783 0.3 OUTLIER 85.84 129.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 C-N-CA 124.712 1.205 . . . . 0.0 112.892 -168.204 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -177.09 5.69 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.976 0 C-N-CA 126.508 1.923 . . . . 0.0 115.607 -162.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -146.51 142.53 28.15 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 123.303 2.774 . . . . 0.0 112.3 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -147.47 127.82 13.96 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.324 1.049 . . . . 0.0 110.558 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.54 122.49 37.18 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 120.118 -1.614 . . . . 0.0 111.213 172.651 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -76.36 -53.25 8.45 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 178.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -65.27 -45.9 92.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 89.6 m -61.5 -45.17 95.35 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.288 13.3 t30 82.76 65.55 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 125.706 1.602 . . . . 0.0 112.269 -170.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -143.73 112.41 6.54 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.601 0.715 . . . . 0.0 112.217 -173.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 76.1 p -80.88 134.88 35.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.99 -1.069 . . . . 0.0 113.591 163.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -161.56 157.97 25.61 Favored 'General case' 0 CA--C 1.564 1.5 0 CA-C-O 123.342 1.544 . . . . 0.0 113.867 -171.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.283 0.5 OUTLIER -101.01 42.54 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.748 -1.114 . . . . 0.0 113.528 160.112 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -132.18 139.5 48.4 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.472 1.13 . . . . 0.0 111.712 -170.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 -90.04 130.28 42.98 Favored Pre-proline 0 CA--C 1.577 1.993 0 CA-C-O 118.021 -0.99 . . . . 0.0 113.164 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.19 -37.19 93.17 Favored 'Trans proline' 0 CA--C 1.574 2.506 0 C-N-CA 122.713 2.276 . . . . 0.0 116.532 172.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 117.845 2.535 . . . . 0.0 117.845 167.168 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.3 t . . . . . 0 CA--C 1.572 1.815 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.575 1.926 0 O-C-N 120.358 -1.463 . . . . 0.0 111.483 -159.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.382 18.1 Cg_endo . . . . . 0 CA--C 1.585 3.05 0 N-CA-C 118.523 2.471 . . . . 0.0 118.523 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.0 154.06 42.21 Favored 'Trans proline' 0 CA--C 1.569 2.264 0 CA-C-N 126.627 3.403 . . . . 0.0 113.442 167.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.562 -1.336 . . . . 0.0 114.206 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 49.7 tttm . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pp -147.44 164.94 20.39 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 174.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -82.06 158.93 18.08 Favored 'Trans proline' 0 CA--C 1.587 3.127 0 N-CA-C 121.963 3.794 . . . . 0.0 121.963 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.07 113.56 2.74 Favored 'Trans proline' 0 CA--C 1.564 2.019 0 C-N-CA 123.357 2.704 . . . . 0.0 112.611 -175.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 24.16 5.66 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -163.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.281 24.1 m95 -115.36 162.59 16.91 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.559 1.68 . . . . 0.0 114.21 175.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 -151.01 0.35 Allowed 'General case' 0 CA--C 1.573 1.861 0 CA-C-O 121.838 0.828 . . . . 0.0 112.09 150.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.77 118.18 7.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.637 -1.29 . . . . 0.0 111.759 -160.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.7 mtt-85 -137.32 113.94 10.32 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 119.992 -1.692 . . . . 0.0 112.923 -159.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -120.47 121.0 37.51 Favored 'General case' 0 CA--C 1.563 1.463 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -130.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' B' ' 16' ' ' ARG 0.279 5.4 t 71.05 132.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 118.741 2.867 . . . . 0.0 118.741 163.697 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -124.87 -56.21 1.58 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.297 -1.502 . . . . 0.0 112.424 157.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 97.0 p -74.74 -43.04 57.02 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 58.1 m -158.47 -54.72 0.07 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.929 -1.107 . . . . 0.0 112.401 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -166.49 64.61 0.21 Allowed Glycine 0 N--CA 1.49 2.294 0 O-C-N 120.944 -1.097 . . . . 0.0 112.813 173.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.461 ' O ' ' HA ' ' B' ' 11' ' ' SER . 3.4 mpt_? -149.98 146.81 27.23 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.593 1.187 . . . . 0.0 112.636 -174.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.711 0.5 OUTLIER 79.73 130.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 120.882 -1.136 . . . . 0.0 112.641 -144.576 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.291 1.1 p90 -175.34 4.32 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.215 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -165.63 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -143.33 141.13 30.86 Favored 'General case' 0 N--CA 1.511 2.613 0 CA-C-N 122.772 2.533 . . . . 0.0 112.801 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -143.9 125.94 15.42 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.585 -1.322 . . . . 0.0 112.303 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.66 125.74 34.98 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.062 -1.649 . . . . 0.0 111.193 172.005 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -77.68 -50.93 11.45 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 175.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 24.4 mm -65.77 -46.38 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -62.54 -43.61 98.38 Favored 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 162.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.519 0.1 OUTLIER 75.79 74.85 0.09 Allowed 'General case' 0 CA--C 1.571 1.759 0 C-N-CA 125.656 1.583 . . . . 0.0 112.578 -163.588 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -141.43 109.59 5.85 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.017 -1.052 . . . . 0.0 111.263 -176.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p -82.23 126.25 31.88 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.541 -0.725 . . . . 0.0 112.822 166.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' GLN . . . . . 0.402 ' HG3' ' H ' ' B' ' 30' ' ' GLU . 7.0 pt20 -146.32 170.14 17.39 Favored 'General case' 0 CA--C 1.565 1.524 0 CA-C-O 123.76 1.743 . . . . 0.0 114.913 -178.088 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.31 1.9 p-90 -115.96 43.23 2.17 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 166.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' GLU . . . . . 0.402 ' H ' ' HG3' ' B' ' 28' ' ' GLN . 0.0 OUTLIER -139.42 159.74 41.46 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 123.125 1.44 . . . . 0.0 110.516 162.659 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -90.48 142.71 28.38 Favored Pre-proline 0 CA--C 1.58 2.125 0 CA-C-N 114.829 -1.078 . . . . 0.0 112.469 166.387 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -60.15 -2.0 1.56 Allowed 'Trans proline' 0 CA--C 1.582 2.906 0 C-N-CA 123.589 2.859 . . . . 0.0 119.141 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.317 7.1 t . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -177.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.0 t . . . . . 0 N--CA 1.505 2.325 0 CA-C-O 121.961 0.886 . . . . 0.0 112.64 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.573 1.836 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -166.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.336 30.6 Cg_endo . . . . . 0 CA--C 1.586 3.087 0 N-CA-C 118.702 2.539 . . . . 0.0 118.702 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -66.52 142.32 64.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 CA-C-N 126.854 3.484 . . . . 0.0 115.149 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -157.461 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 tptp . . . . . 0 N--CA 1.495 1.82 0 N-CA-C 111.025 0.009 . . . . 0.0 111.025 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.7 174.55 2.55 Favored Pre-proline 0 CA--C 1.589 2.452 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 165.194 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -72.92 157.08 51.95 Favored 'Trans proline' 0 CA--C 1.589 3.238 0 N-CA-C 121.782 3.724 . . . . 0.0 121.782 -174.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -72.21 135.01 24.04 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 C-N-CA 123.278 2.652 . . . . 0.0 113.123 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.7 27.77 45.45 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 118.821 2.289 . . . . 0.0 118.821 -165.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.28 23.1 m95 -111.3 162.53 14.91 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 120.004 1.902 . . . . 0.0 114.083 170.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.71 -155.15 0.59 Allowed 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 122.193 0.997 . . . . 0.0 112.505 149.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.33 120.37 10.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.913 -1.117 . . . . 0.0 111.567 -159.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.1 mtt-85 -136.66 115.74 12.43 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.24 -1.537 . . . . 0.0 113.338 -160.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.7 mtp -108.89 107.05 17.29 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -158.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' SER . . . . . 0.559 ' H ' ' HB ' ' B' ' 17' ' ' VAL 0.285 5.8 p 65.93 -163.1 0.25 Allowed 'General case' 0 CA--C 1.579 2.076 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 164.262 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -124.87 -75.18 0.6 Allowed 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.4 p -139.63 85.95 2.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 144.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 21.0 m -155.7 -27.69 0.1 Allowed 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 -158.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.19 44.32 7.61 Favored Glycine 0 N--CA 1.499 2.847 0 CA-C-N 121.213 1.824 . . . . 0.0 115.638 -170.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -137.57 172.5 12.87 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.494 1.118 . . . . 0.0 111.157 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.559 ' HB ' ' H ' ' B' ' 11' ' ' SER 0.535 2.2 t 71.82 141.44 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.58 2.122 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 160.949 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.279 3.0 p90 -170.39 10.48 0.02 OUTLIER 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 -171.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -148.86 145.52 27.52 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 123.183 2.719 . . . . 0.0 113.602 -176.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -151.7 127.2 10.05 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.899 -1.126 . . . . 0.0 111.135 177.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.6 126.66 40.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.216 -1.552 . . . . 0.0 111.003 170.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -79.14 -45.79 19.28 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mt -66.81 -51.78 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 124.302 1.041 . . . . 0.0 112.96 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 85.7 m -56.65 -46.13 81.22 Favored 'General case' 0 CA--C 1.577 2.018 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 163.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.523 0.0 OUTLIER 76.21 65.98 0.06 Allowed 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 125.462 1.505 . . . . 0.0 112.302 -163.72 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -125.09 122.7 37.95 Favored 'General case' 0 CA--C 1.557 1.222 0 O-C-N 121.185 -0.947 . . . . 0.0 110.418 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -99.69 121.43 41.22 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.973 -0.455 . . . . 0.0 110.937 167.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -153.51 171.1 19.24 Favored 'General case' 0 CA--C 1.562 1.407 0 CA-C-O 123.364 1.554 . . . . 0.0 113.21 -164.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.314 0.6 OUTLIER -127.11 51.1 1.91 Allowed 'General case' 0 CA--C 1.567 1.601 0 O-C-N 121.12 -0.988 . . . . 0.0 113.251 166.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -135.93 140.15 43.8 Favored 'General case' 0 CA--C 1.56 1.353 0 CA-C-O 122.238 1.018 . . . . 0.0 110.593 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 52.8 ttp85 -81.26 128.12 71.51 Favored Pre-proline 0 CA--C 1.576 1.961 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.83 171.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -61.25 6.5 0.14 Allowed 'Trans proline' 0 CA--C 1.581 2.843 0 N-CA-C 120.03 3.05 . . . . 0.0 120.03 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.384 37.7 p . . . . . 0 N--CA 1.498 1.973 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 N--CA 1.498 1.944 0 CA-C-O 122.036 0.922 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 16.2 mtp-105 . . . . . 0 CA--C 1.568 1.636 0 CA-C-O 122.322 1.058 . . . . 0.0 113.782 -171.159 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.277 24.3 Cg_endo . . . . . 0 CA--C 1.575 2.566 0 N-CA-C 117.265 1.987 . . . . 0.0 117.265 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.83 -103.26 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.666 0 CA-C-N 125.086 2.852 . . . . 0.0 112.267 162.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? . . . . . 0 CA--C 1.577 1.994 0 CA-C-N 119.613 1.097 . . . . 0.0 112.014 167.417 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 10.5 pttp . . . . . 0 CA--C 1.576 1.956 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.3 171.07 10.52 Favored Pre-proline 0 CA--C 1.589 2.469 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 163.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -73.31 154.83 51.41 Favored 'Trans proline' 0 CA--C 1.59 3.306 0 N-CA-C 122.118 3.853 . . . . 0.0 122.118 -172.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -71.62 129.41 15.61 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.96 2.44 . . . . 0.0 113.009 173.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.64 7.84 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 117.322 1.689 . . . . 0.0 117.322 -160.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -123.4 169.87 10.92 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-N 120.362 2.081 . . . . 0.0 116.477 171.035 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.07 178.81 8.39 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-O 124.12 1.914 . . . . 0.0 111.836 144.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.271 0.2 OUTLIER -100.42 127.08 46.84 Favored 'General case' 0 CA--C 1.573 1.828 0 CA-C-N 114.135 -1.393 . . . . 0.0 112.406 169.188 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -129.61 126.19 37.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.228 -1.545 . . . . 0.0 109.699 -170.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 86.3 mmm -112.77 136.0 52.88 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -156.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' SER . . . . . 0.432 ' H ' ' HB ' ' B' ' 17' ' ' VAL 0.261 24.3 p 47.86 61.17 3.1 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 121.342 3.83 . . . . 0.0 121.342 137.5 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -71.31 -15.48 62.41 Favored 'General case' 0 CA--C 1.582 2.18 0 N-CA-C 117.325 2.343 . . . . 0.0 117.325 165.114 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -131.15 174.66 9.81 Favored 'General case' 0 CA--C 1.578 2.036 0 O-C-N 120.871 -1.143 . . . . 0.0 110.433 155.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 14.7 t -68.75 96.3 0.73 Allowed 'General case' 0 CA--C 1.57 1.729 0 N-CA-C 115.61 1.708 . . . . 0.0 115.61 -164.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.02 55.08 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 115.49 0.956 . . . . 0.0 115.49 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -141.19 163.73 32.18 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.12 0.968 . . . . 0.0 110.398 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.432 ' HB ' ' H ' ' B' ' 11' ' ' SER 0.483 1.6 t 66.23 132.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.579 2.089 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 162.345 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.337 6.5 p90 -165.8 2.57 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.82 0 O-C-N 119.717 -1.864 . . . . 0.0 116.016 -171.292 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -144.01 156.77 44.52 Favored 'General case' 0 N--CA 1.502 2.148 0 CA-C-N 122.793 2.542 . . . . 0.0 114.142 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -161.75 129.75 4.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.294 -1.504 . . . . 0.0 109.441 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -83.65 125.61 32.03 Favored 'General case' 0 CA--C 1.576 1.943 0 O-C-N 120.106 -1.621 . . . . 0.0 110.645 168.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.75 -45.36 15.76 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 25.4 pt -67.12 -33.5 63.52 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 69.9 p -74.43 -49.59 21.84 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 114.773 1.398 . . . . 0.0 114.773 158.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.329 0.8 OUTLIER 82.6 58.83 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.996 0 C-N-CA 125.93 1.692 . . . . 0.0 112.592 -163.791 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -117.91 123.69 46.43 Favored 'General case' 0 CA--C 1.563 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 111.265 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 28.0 m -88.91 134.03 34.1 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.311 -0.868 . . . . 0.0 112.646 175.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -147.61 172.05 14.63 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 123.73 1.728 . . . . 0.0 113.424 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -121.92 60.62 0.97 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.314 -1.491 . . . . 0.0 110.358 163.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -156.77 130.18 8.07 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-O 121.977 0.894 . . . . 0.0 111.28 -152.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 -93.77 132.78 29.08 Favored Pre-proline 0 CA--C 1.573 1.852 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.168 -175.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -64.76 11.11 0.12 Allowed 'Trans proline' 0 CA--C 1.58 2.782 0 N-CA-C 119.499 2.846 . . . . 0.0 119.499 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.32 9.7 t . . . . . 0 N--CA 1.496 1.872 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.435 HG11 ' HD2' ' B' ' 9' ' ' ARG 0.258 13.6 t . . . . . 0 N--CA 1.503 2.208 0 CA-C-O 121.436 0.636 . . . . 0.0 110.063 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 122.128 0.966 . . . . 0.0 112.607 -172.511 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo . . . . . 0 CA--C 1.575 2.555 0 N-CA-C 118.804 2.579 . . . . 0.0 118.804 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.03 -63.68 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.282 0 CA-C-N 125.886 3.138 . . . . 0.0 115.532 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.046 . . . . 0.0 112.127 174.776 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 117.056 -1.45 . . . . 0.0 111.652 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.324 1.2 pp 47.82 175.76 0.01 OUTLIER Pre-proline 0 N--CA 1.51 2.559 0 N-CA-C 120.16 3.392 . . . . 0.0 120.16 175.906 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -78.94 158.05 27.3 Favored 'Trans proline' 0 CA--C 1.587 3.15 0 N-CA-C 122.126 3.856 . . . . 0.0 122.126 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.74 127.02 8.48 Favored 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 123.271 2.648 . . . . 0.0 113.133 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.21 23.82 16.14 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 118.095 1.998 . . . . 0.0 118.095 -163.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.283 22.1 m95 -119.52 169.28 10.19 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 120.87 2.335 . . . . 0.0 115.848 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -134.71 164.88 26.54 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 124.957 2.313 . . . . 0.0 113.731 151.156 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.33 123.89 30.08 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-N 112.783 -2.008 . . . . 0.0 110.177 142.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' ARG . . . . . 0.611 ' O ' HG13 ' B' ' 17' ' ' VAL . 2.7 mtt-85 -122.77 102.38 8.0 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 121.684 2.038 . . . . 0.0 110.599 -173.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.43 115.18 29.7 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -155.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 26.5 p 67.7 131.29 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.611 2.449 . . . . 0.0 117.611 168.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.61 -68.92 0.56 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.587 -1.321 . . . . 0.0 107.643 160.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 88.8 p -93.88 111.16 22.82 Favored 'General case' 0 CA--C 1.572 1.815 0 O-C-N 120.819 -1.175 . . . . 0.0 112.706 166.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . 0.278 38.8 p 63.88 40.27 7.57 Favored 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 119.885 3.291 . . . . 0.0 119.885 169.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.73 33.11 38.86 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 117.244 1.658 . . . . 0.0 117.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.408 ' O ' HG12 ' B' ' 17' ' ' VAL . 9.4 mpt_? -116.96 126.08 52.39 Favored 'General case' 0 CA--C 1.565 1.552 0 CA-C-N 118.487 1.143 . . . . 0.0 111.236 -171.218 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.611 HG13 ' O ' ' B' ' 9' ' ' ARG 0.846 0.7 OUTLIER 110.4 148.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.417 1.887 . . . . 0.0 114.565 -179.131 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.394 10.2 p90 -170.46 12.23 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.252 0 C-N-CA 126.272 1.829 . . . . 0.0 115.383 176.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -148.47 137.67 21.84 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 122.364 2.347 . . . . 0.0 111.986 165.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -143.02 135.45 27.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.637 -1.914 . . . . 0.0 110.844 173.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.22 120.55 31.47 Favored 'General case' 0 CA--C 1.57 1.739 0 O-C-N 120.203 -1.561 . . . . 0.0 110.536 169.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -76.7 -43.97 35.47 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 26.5 pt -71.64 -35.98 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 80.4 p -71.36 -50.76 29.0 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 159.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.317 34.7 t-20 83.72 64.74 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 126.115 1.766 . . . . 0.0 112.162 -163.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -128.49 118.75 23.6 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 123.514 0.726 . . . . 0.0 111.455 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 89.6 p -86.42 128.23 34.92 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -0.964 . . . . 0.0 113.301 171.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -137.72 177.8 7.59 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.031 1.396 . . . . 0.0 111.887 175.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.366 0.1 OUTLIER -128.74 47.09 2.5 Favored 'General case' 0 CA--C 1.571 1.785 0 O-C-N 119.794 -1.816 . . . . 0.0 114.097 164.092 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -147.56 160.38 42.7 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-O 125.329 2.49 . . . . 0.0 109.587 167.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.313 17.7 ttp-105 -64.53 155.87 79.56 Favored Pre-proline 0 CA--C 1.569 1.709 0 CA-C-N 112.842 -1.981 . . . . 0.0 116.239 171.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.21 65.7 1.46 Allowed 'Trans proline' 0 CA--C 1.573 2.429 0 C-N-CA 122.233 1.955 . . . . 0.0 112.258 154.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 CA--C 1.574 1.883 0 N-CA-C 119.841 3.275 . . . . 0.0 119.841 176.229 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.504 2.261 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? . . . . . 0 N--CA 1.504 2.266 0 N-CA-C 117.507 2.41 . . . . 0.0 117.507 -160.273 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 CA--C 1.578 2.698 0 N-CA-C 117.497 2.076 . . . . 0.0 117.497 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -72.86 92.5 0.79 Allowed 'Trans proline' 0 CA--C 1.566 2.082 0 CA-C-N 125.566 3.023 . . . . 0.0 111.589 171.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.571 1.759 0 CA-C-N 113.519 -1.673 . . . . 0.0 114.664 -165.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? . . . . . 0 CA--C 1.572 1.814 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.87 169.17 10.23 Favored Pre-proline 0 CA--C 1.588 2.42 0 N-CA-C 116.363 1.986 . . . . 0.0 116.363 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -70.88 153.61 63.7 Favored 'Trans proline' 0 CA--C 1.588 3.191 0 N-CA-C 122.157 3.868 . . . . 0.0 122.157 -172.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.21 126.74 10.68 Favored 'Trans proline' 0 CA--C 1.566 2.096 0 C-N-CA 123.183 2.589 . . . . 0.0 112.664 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.89 28.36 10.17 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 -161.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.254 12.6 m95 -114.54 162.96 16.04 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.276 2.038 . . . . 0.0 114.072 171.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -153.92 141.38 19.74 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-O 123.285 1.517 . . . . 0.0 114.916 152.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.44 128.17 35.82 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 166.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -129.59 106.88 9.04 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-N 120.494 1.497 . . . . 0.0 111.441 -174.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 3.2 ttm -114.82 129.3 56.67 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -132.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.344 24.5 p 78.42 157.85 0.17 Allowed 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 154.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -151.42 -50.55 0.12 Allowed 'General case' 0 CA--C 1.57 1.748 0 C-N-CA 124.524 1.13 . . . . 0.0 112.318 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 93.2 p -100.16 -61.89 1.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.0 112.786 157.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 97.3 p -119.15 -59.49 1.84 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -163.52 45.28 0.32 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 116.863 1.505 . . . . 0.0 116.863 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.12 144.32 44.3 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.548 1.139 . . . . 0.0 113.303 169.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.731 0.5 OUTLIER 73.45 124.84 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 CA-C-N 115.274 -0.875 . . . . 0.0 112.416 -142.68 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.308 9.8 p90 -172.29 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.16 0 CA-C-O 116.08 -1.914 . . . . 0.0 114.841 -174.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -153.85 148.79 26.66 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 124.357 3.253 . . . . 0.0 115.591 174.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -161.48 136.55 7.44 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 125.903 1.681 . . . . 0.0 109.123 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.12 128.47 44.07 Favored 'General case' 0 CA--C 1.571 1.752 0 O-C-N 120.27 -1.519 . . . . 0.0 110.642 172.333 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -75.16 -55.83 5.33 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.162 -1.586 . . . . 0.0 114.163 174.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -60.64 -35.16 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.36 -17.42 23.57 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 164.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.326 3.0 t-20 64.59 24.44 13.02 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 -164.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.54 150.73 43.27 Favored 'General case' 0 CA--C 1.573 1.863 0 O-C-N 119.599 -1.938 . . . . 0.0 114.273 164.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.4 m -152.56 122.09 6.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.964 -1.71 . . . . 0.0 111.2 -170.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -162.55 177.08 9.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 124.051 1.882 . . . . 0.0 112.952 -150.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.273 0.1 OUTLIER -119.01 39.44 3.54 Favored 'General case' 0 CA--C 1.577 1.995 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.824 155.939 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -127.13 134.14 50.25 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 122.394 1.093 . . . . 0.0 110.396 -167.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -90.56 123.97 63.84 Favored Pre-proline 0 CA--C 1.574 1.903 0 CA-C-O 117.897 -1.049 . . . . 0.0 113.512 -172.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -60.02 -39.83 66.89 Favored 'Trans proline' 0 CA--C 1.569 2.261 0 N-CA-C 117.845 2.21 . . . . 0.0 117.845 171.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.34 1.2 m . . . . . 0 N--CA 1.499 2.011 0 C-N-CA 125.134 1.374 . . . . 0.0 114.606 -165.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.333 2.4 t . . . . . 0 N--CA 1.503 2.207 0 CA-C-O 121.262 0.553 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.264 24.2 ptt-85 . . . . . 0 N--CA 1.501 2.113 0 O-C-N 119.878 -1.763 . . . . 0.0 115.759 -156.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.293 18.1 Cg_endo . . . . . 0 CA--C 1.582 2.912 0 N-CA-C 119.548 2.865 . . . . 0.0 119.548 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -70.37 -49.31 0.48 Allowed 'Trans proline' 0 CA--C 1.567 2.127 0 CA-C-N 126.187 3.245 . . . . 0.0 117.487 -174.106 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.801 0 O-C-N 120.912 -1.118 . . . . 0.0 111.912 165.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 20.4 tptm . . . . . 0 CA--C 1.577 2.006 0 CA-C-O 120.941 0.401 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -144.59 176.28 2.33 Favored Pre-proline 0 CA--C 1.587 2.38 0 C-N-CA 124.471 1.109 . . . . 0.0 109.485 164.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -76.13 157.32 38.07 Favored 'Trans proline' 0 CA--C 1.584 3.016 0 N-CA-C 121.21 3.504 . . . . 0.0 121.21 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -79.19 124.33 5.95 Favored 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.117 2.545 . . . . 0.0 112.879 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.39 30.7 9.62 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 117.944 1.937 . . . . 0.0 117.944 -164.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' TRP . . . . . 0.504 ' CZ2' ' HG3' ' B' ' 32' ' ' PRO 0.268 22.4 m95 -114.13 162.82 16.02 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.506 1.653 . . . . 0.0 114.102 170.663 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -147.75 -148.62 0.26 Allowed 'General case' 0 CA--C 1.573 1.83 0 CA-C-O 121.93 0.871 . . . . 0.0 112.468 149.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.77 118.24 9.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.76 -1.212 . . . . 0.0 111.157 -161.273 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 mtt-85 -140.75 121.72 14.58 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.184 -1.573 . . . . 0.0 112.075 -161.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.5 mtp -113.18 142.33 45.9 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 118.355 2.724 . . . . 0.0 118.355 -150.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.301 46.7 m 65.57 62.11 0.67 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 118.495 2.776 . . . . 0.0 118.495 155.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 12' ' ' ARG . . . . . 0.463 ' H ' HG12 ' B' ' 17' ' ' VAL . 16.0 mtp180 -65.75 -29.26 69.75 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 156.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 74.9 m -133.63 136.78 45.04 Favored 'General case' 0 CA--C 1.563 1.469 0 O-C-N 120.477 -1.39 . . . . 0.0 108.588 156.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 49.9 m -35.23 102.26 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 119.068 2.988 . . . . 0.0 119.068 -165.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 99.18 -0.4 57.27 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 119.047 2.379 . . . . 0.0 119.047 -173.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? -127.59 128.15 45.08 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 120.484 2.142 . . . . 0.0 112.371 -166.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.463 HG12 ' H ' ' B' ' 12' ' ' ARG 0.82 0.3 OUTLIER 99.46 135.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 C-N-CA 125.892 1.677 . . . . 0.0 112.217 -160.199 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.3 2.5 p90 -173.74 9.49 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.325 0 C-N-CA 126.184 1.794 . . . . 0.0 115.712 -170.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -147.27 144.92 29.19 Favored 'General case' 0 N--CA 1.511 2.603 0 CA-C-N 122.673 2.488 . . . . 0.0 112.982 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -152.89 129.79 10.98 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.137 -1.602 . . . . 0.0 112.666 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.71 125.04 37.15 Favored 'General case' 0 CA--C 1.573 1.831 0 O-C-N 120.197 -1.564 . . . . 0.0 111.063 168.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 -68.6 -42.5 78.07 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 9.0 mt -71.4 -54.84 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.166 0.986 . . . . 0.0 112.763 -171.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' THR . . . . . 0.589 HG23 ' H ' ' B' ' 26' ' ' ALA . 9.1 t -81.33 -15.98 53.74 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 171.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.285 6.4 t-20 61.9 17.47 8.94 Favored 'General case' 0 CA--C 1.582 2.193 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 -160.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' ALA . . . . . 0.589 ' H ' HG23 ' B' ' 24' ' ' THR . . . -58.9 96.85 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 O-C-N 119.874 -1.766 . . . . 0.0 113.29 162.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 9.3 m -113.59 122.75 48.15 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -170.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.86 163.69 38.91 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 124.154 1.931 . . . . 0.0 115.074 -154.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -102.42 49.12 0.85 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 113.846 -1.524 . . . . 0.0 112.378 168.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -161.04 138.77 9.33 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 123.092 1.425 . . . . 0.0 111.045 -148.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 68.8 ttt-85 -107.33 112.54 62.67 Favored Pre-proline 0 CA--C 1.573 1.839 0 CA-C-O 117.772 -1.109 . . . . 0.0 112.884 -155.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' PRO . . . . . 0.504 ' HG3' ' CZ2' ' B' ' 6' ' ' TRP . 39.2 Cg_endo -68.36 -48.5 1.17 Allowed 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 122.408 2.072 . . . . 0.0 115.335 174.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.498 1.951 0 N-CA-C 118.828 2.899 . . . . 0.0 118.828 177.353 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.6 t . . . . . 0 N--CA 1.505 2.305 0 CA-C-O 123.937 1.827 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.574 1.888 0 CA-C-N 113.435 -1.711 . . . . 0.0 115.099 -172.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.253 6.3 Cg_exo . . . . . 0 CA--C 1.573 2.442 0 N-CA-C 118.524 2.471 . . . . 0.0 118.524 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -80.25 -111.61 0.01 OUTLIER 'Trans proline' 0 CA--C 1.572 2.397 0 CA-C-N 125.343 2.944 . . . . 0.0 112.507 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.568 1.648 0 O-C-N 120.317 -1.489 . . . . 0.0 110.388 172.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? . . . . . 0 CA--C 1.57 1.736 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -63.08 170.82 2.35 Favored Pre-proline 0 CA--C 1.586 2.364 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . 0.25 33.6 Cg_exo -68.1 155.6 68.93 Favored 'Trans proline' 0 CA--C 1.593 3.44 0 N-CA-C 122.45 3.981 . . . . 0.0 122.45 -172.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -73.41 135.73 22.79 Favored 'Trans proline' 0 CA--C 1.563 1.975 0 C-N-CA 123.311 2.674 . . . . 0.0 112.694 175.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.06 32.15 26.91 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 -161.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.261 17.1 m95 -116.68 162.44 17.65 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 120.589 2.195 . . . . 0.0 114.521 170.209 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.95 -148.1 0.24 Allowed 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.966 0.889 . . . . 0.0 111.671 150.066 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -149.49 118.93 6.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.227 -1.546 . . . . 0.0 110.415 -163.121 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -137.93 115.48 11.26 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.098 -1.626 . . . . 0.0 114.449 -161.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' MET . . . . . 0.407 ' HA ' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -101.11 114.04 27.62 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -152.551 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 78.9 p 46.7 87.33 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 119.998 3.332 . . . . 0.0 119.998 169.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . 0.256 0.0 OUTLIER -56.03 -40.49 73.53 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 173.005 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 84.9 p -160.6 55.49 0.32 Allowed 'General case' 0 CA--C 1.576 1.974 0 C-N-CA 124.283 1.033 . . . . 0.0 111.584 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -164.82 -114.34 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.399 -1.438 . . . . 0.0 109.809 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -161.33 26.69 0.27 Allowed Glycine 0 N--CA 1.498 2.816 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 172.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -138.47 170.7 15.56 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 125.019 1.327 . . . . 0.0 109.408 171.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 10' ' ' MET 0.809 0.3 OUTLIER 93.31 131.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 120.774 -1.204 . . . . 0.0 111.723 -156.543 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.339 1.4 p90 -177.83 8.73 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.477 0 C-N-CA 126.084 1.754 . . . . 0.0 114.606 -167.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -136.12 137.44 41.01 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 119.185 -2.197 . . . . 0.0 109.373 174.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -140.12 130.28 25.04 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 119.509 -1.994 . . . . 0.0 112.922 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.63 129.7 39.81 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.091 -1.631 . . . . 0.0 111.149 171.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -82.69 -53.56 5.82 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 175.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 31.1 pt -62.94 -50.0 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 94.5 m -58.17 -42.3 85.71 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 158.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.314 11.5 t-20 77.5 73.02 0.06 Allowed 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 125.763 1.625 . . . . 0.0 109.433 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -152.0 134.56 15.38 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.535 -0.728 . . . . 0.0 111.811 -169.377 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 92.5 p -86.62 131.7 34.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.023 -1.048 . . . . 0.0 112.555 161.026 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.274 1.3 pt20 -133.68 161.72 33.89 Favored 'General case' 0 CA--C 1.566 1.571 0 CA-C-O 122.573 1.177 . . . . 0.0 112.682 167.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.276 0.1 OUTLIER -108.87 19.61 19.42 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 170.235 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -157.56 38.89 0.28 Allowed 'General case' 0 CA--C 1.567 1.607 0 N-CA-C 119.869 3.285 . . . . 0.0 119.869 -171.463 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 54.28 142.67 0.03 OUTLIER Pre-proline 0 CA--C 1.59 2.493 0 N-CA-C 121.393 3.849 . . . . 0.0 121.393 166.379 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -69.45 3.24 2.74 Favored 'Trans proline' 0 CA--C 1.578 2.684 0 N-CA-C 118.36 2.408 . . . . 0.0 118.36 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.358 8.6 m . . . . . 0 N--CA 1.501 2.083 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 -172.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 119.028 -0.511 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -71.94 144.04 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 CA-C-N 119.242 0.928 . . . . 0.0 112.236 168.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.2 t -148.93 141.18 24.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.868 -1.145 . . . . 0.0 113.51 -175.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.7 155.2 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.091 0 O-C-N 121.63 -0.669 . . . . 0.0 111.59 150.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.0 t -76.99 123.33 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 CA-C-O 121.971 0.891 . . . . 0.0 109.081 174.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.75 99.11 9.32 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 122.598 1.19 . . . . 0.0 113.555 -172.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.294 9.7 Cg_endo -53.3 -53.64 6.32 Favored 'Trans proline' 0 CA--C 1.578 2.694 0 CA-C-N 123.929 2.439 . . . . 0.0 117.89 -173.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -83.06 -117.62 0.01 OUTLIER 'Trans proline' 0 CA--C 1.582 2.915 0 CA-C-N 123.987 2.46 . . . . 0.0 111.885 162.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -147.55 178.11 8.71 Favored 'General case' 0 CA--C 1.576 1.95 0 O-C-N 120.202 -1.561 . . . . 0.0 111.244 164.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.7 t -65.21 138.25 97.17 Favored Pre-proline 0 CA--C 1.584 2.268 0 O-C-N 120.54 -1.35 . . . . 0.0 113.736 164.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -78.19 49.56 3.04 Favored 'Trans proline' 0 CA--C 1.577 2.65 0 N-CA-C 118.467 2.449 . . . . 0.0 118.467 -176.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.254 1.298 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 152.314 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 CA--C 1.581 2.162 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pp -74.71 171.66 10.94 Favored Pre-proline 0 CA--C 1.589 2.477 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -72.79 156.27 53.11 Favored 'Trans proline' 0 CA--C 1.586 3.107 0 N-CA-C 121.958 3.792 . . . . 0.0 121.958 -174.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.28 129.26 15.72 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 C-N-CA 123.029 2.486 . . . . 0.0 113.605 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.95 28.82 24.87 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 118.578 2.191 . . . . 0.0 118.578 -167.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.251 16.5 m95 -109.76 177.09 4.83 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 120.241 2.021 . . . . 0.0 116.352 173.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -148.56 162.36 39.81 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-O 124.122 1.915 . . . . 0.0 111.081 147.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.254 0.1 OUTLIER -101.14 116.75 33.54 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.541 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -101.05 160.23 14.55 Favored 'General case' 0 CA--C 1.557 1.224 0 O-C-N 120.093 -1.63 . . . . 0.0 107.98 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.18 125.04 13.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -173.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.292 20.7 p 74.99 146.63 0.09 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 119.047 2.98 . . . . 0.0 119.047 157.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 39.8 mtm-85 -130.0 -68.64 0.7 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.91 -1.119 . . . . 0.0 110.11 162.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 96.2 p -115.68 -70.65 0.78 Allowed 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 119.194 0.907 . . . . 0.0 111.941 170.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 34.0 t -72.18 1.98 6.66 Favored 'General case' 0 CA--C 1.579 2.096 0 N-CA-C 119.227 3.047 . . . . 0.0 119.227 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.66 54.61 1.91 Allowed Glycine 0 N--CA 1.489 2.169 0 CA-C-N 120.704 1.593 . . . . 0.0 113.628 -177.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -136.29 137.77 41.05 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 123.207 1.479 . . . . 0.0 113.676 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.434 HG22 ' H ' ' B' ' 18' ' ' TYR 0.802 1.1 p 135.1 148.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 C-N-CA 129.239 3.016 . . . . 0.0 111.642 177.723 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.434 ' H ' HG22 ' B' ' 17' ' ' VAL 0.345 52.4 m-85 -135.95 -48.2 0.67 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -159.05 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -155.38 146.82 22.91 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 123.11 1.433 . . . . 0.0 113.615 -160.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -151.42 122.53 7.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.512 -1.367 . . . . 0.0 108.55 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.35 124.24 27.6 Favored 'General case' 0 CA--C 1.57 1.744 0 O-C-N 119.736 -1.852 . . . . 0.0 110.833 174.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.33 -46.82 11.37 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -175.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.5 pt -61.82 -45.09 99.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.281 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 172.595 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 55.3 m -66.58 -48.11 70.63 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 165.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.343 53.4 m-80 77.97 68.41 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.673 0 C-N-CA 126.499 1.92 . . . . 0.0 112.656 -166.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -137.71 124.5 21.16 Favored 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.777 0.831 . . . . 0.0 110.739 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 37.4 m -83.39 142.26 31.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.377 -0.827 . . . . 0.0 112.892 172.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.27 10.1 pt20 -148.17 173.42 12.99 Favored 'General case' 0 CA--C 1.562 1.426 0 CA-C-O 123.58 1.657 . . . . 0.0 113.305 166.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.305 0.1 OUTLIER -111.33 39.69 2.25 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 169.297 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.11 160.1 40.71 Favored 'General case' 0 CA--C 1.563 1.472 0 CA-C-O 123.728 1.727 . . . . 0.0 111.228 174.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.25 15.2 ttt85 -54.2 157.49 4.56 Favored Pre-proline 0 CA--C 1.585 2.314 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 159.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -60.52 17.9 0.04 OUTLIER 'Trans proline' 0 CA--C 1.584 3.02 0 N-CA-C 119.173 2.72 . . . . 0.0 119.173 164.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.322 8.4 t 67.58 -76.69 0.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.538 1.535 . . . . 0.0 114.253 -172.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 50.77 51.88 32.02 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 120.715 3.046 . . . . 0.0 120.715 172.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -142.12 101.27 3.89 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 117.821 0.81 . . . . 0.0 109.585 -177.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 18.0 m -69.98 155.25 40.85 Favored 'General case' 0 CA--C 1.57 1.719 0 N-CA-C 116.02 1.859 . . . . 0.0 116.02 -177.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 58.4 m -148.6 -59.49 0.23 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.094 -1.004 . . . . 0.0 112.622 174.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 77.9 p -125.57 72.15 1.25 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.212 -0.93 . . . . 0.0 109.767 165.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.075 0 CA-C-O 118.89 -0.95 . . . . 0.0 110.982 -145.442 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.7 tptm . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 119.274 -0.393 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.9 t -79.0 142.14 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 CA-C-N 118.702 0.683 . . . . 0.0 110.206 168.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.7 t -142.78 112.24 6.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.28 -0.887 . . . . 0.0 110.567 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 72.3 t -78.21 102.86 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.302 3.4 t 76.94 112.42 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 C-N-CA 124.439 1.096 . . . . 0.0 109.797 -168.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 35.0 ttp85 -143.59 148.16 35.46 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.969 -1.082 . . . . 0.0 113.471 -168.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.282 13.4 Cg_endo -57.96 -61.12 0.3 Allowed 'Trans proline' 0 CA--C 1.585 3.052 0 C-N-CA 122.68 2.254 . . . . 0.0 116.805 169.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -80.06 -111.37 0.01 OUTLIER 'Trans proline' 0 CA--C 1.578 2.704 0 CA-C-N 125.018 2.828 . . . . 0.0 112.942 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -157.51 159.95 37.73 Favored 'General case' 0 CA--C 1.573 1.841 0 O-C-N 120.546 -1.347 . . . . 0.0 112.194 167.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.3 t -58.94 147.7 72.46 Favored Pre-proline 0 CA--C 1.586 2.338 0 CA-C-O 117.555 -1.212 . . . . 0.0 113.789 154.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.53 75.64 3.42 Favored 'Trans proline' 0 CA--C 1.573 2.439 0 CA-C-N 123.372 2.24 . . . . 0.0 117.414 -170.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.3 p . . . . . 0 N--CA 1.484 1.229 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 171.118 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.584 2.255 0 N-CA-C 118.071 2.619 . . . . 0.0 118.071 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.372 0.6 OUTLIER 50.41 163.62 0.04 OUTLIER Pre-proline 0 CA--C 1.59 2.481 0 N-CA-C 118.205 2.668 . . . . 0.0 118.205 -157.313 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -77.72 156.02 31.34 Favored 'Trans proline' 0 CA--C 1.591 3.366 0 N-CA-C 121.927 3.78 . . . . 0.0 121.927 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.34 130.54 15.23 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.135 2.556 . . . . 0.0 112.648 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.72 25.74 17.04 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 118.017 1.967 . . . . 0.0 118.017 -161.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.276 26.5 m95 -117.61 171.46 8.01 Favored 'General case' 0 CA--C 1.561 1.398 0 CA-C-N 120.387 2.094 . . . . 0.0 115.856 172.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -157.55 137.18 12.16 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 122.454 1.121 . . . . 0.0 113.187 147.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.67 127.53 32.76 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 174.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 14.8 mtt-85 -137.07 111.62 8.65 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.996 -1.69 . . . . 0.0 110.737 -167.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 28.7 mtp -114.6 141.76 47.34 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 116.906 2.188 . . . . 0.0 116.906 -138.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.266 54.3 p 60.68 64.99 1.09 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 137.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 62.1 mtm180 -88.63 -12.18 43.25 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 68.9 m -144.64 -112.29 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.483 -1.386 . . . . 0.0 108.255 166.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 48.2 m -86.48 56.56 4.05 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 121.45 1.932 . . . . 0.0 115.176 -175.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.5 53.3 6.07 Favored Glycine 0 N--CA 1.489 2.174 0 O-C-N 120.514 -1.366 . . . . 0.0 114.719 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -132.8 144.47 50.26 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 122.259 1.028 . . . . 0.0 112.191 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.678 0.5 OUTLIER 73.27 135.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -159.113 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.351 1.9 p90 -175.02 7.07 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.311 0 C-N-CA 126.281 1.833 . . . . 0.0 114.905 -169.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -146.49 148.11 31.89 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 122.42 2.373 . . . . 0.0 112.76 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -150.58 123.37 8.64 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.112 -1.617 . . . . 0.0 108.199 173.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.28 126.1 33.43 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 119.959 -1.713 . . . . 0.0 110.641 172.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -88.17 -46.68 9.06 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.297 1.962 . . . . 0.0 116.297 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 33.5 pt -58.93 -40.26 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 56.4 m -71.55 -45.48 62.21 Favored 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 160.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.327 6.2 t30 79.04 67.91 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 125.838 1.655 . . . . 0.0 112.366 -169.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -142.38 122.65 13.88 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.391 0.676 . . . . 0.0 111.641 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 79.4 p -81.04 134.15 35.62 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -153.4 167.6 28.87 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.259 0.2 OUTLIER -113.3 36.92 3.35 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-N 113.622 -1.626 . . . . 0.0 114.986 169.937 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -148.14 157.4 43.48 Favored 'General case' 0 CA--C 1.571 1.767 0 CA-C-O 125.588 2.613 . . . . 0.0 111.408 167.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.341 18.7 ttp-105 -69.05 150.98 97.41 Favored Pre-proline 0 CA--C 1.58 2.13 0 CA-C-N 112.09 -2.323 . . . . 0.0 115.655 174.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.34 -35.92 98.89 Favored 'Trans proline' 0 CA--C 1.57 2.278 0 C-N-CA 122.614 2.209 . . . . 0.0 117.083 168.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.314 1.6 t 73.0 -41.1 0.49 Allowed 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 165.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.86 25.55 69.18 Favored Glycine 0 N--CA 1.499 2.857 0 N-CA-C 120.015 2.766 . . . . 0.0 120.015 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -92.18 84.88 5.31 Favored 'General case' 0 CA--C 1.567 1.632 0 CA-C-N 119.045 1.422 . . . . 0.0 112.061 -171.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 23.1 t -136.82 -62.1 0.65 Allowed 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 123.306 0.642 . . . . 0.0 112.517 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 7.3 m -75.89 110.19 10.14 Favored 'General case' 0 CA--C 1.565 1.524 0 CA-C-O 124.478 2.085 . . . . 0.0 113.816 175.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 31.6 t -99.96 64.85 1.25 Allowed 'General case' 0 CA--C 1.575 1.907 0 CA-C-N 112.148 -2.297 . . . . 0.0 110.486 138.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.935 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -150.608 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.575 1.932 0 CA-C-O 119.183 -0.437 . . . . 0.0 110.713 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.9 t -78.39 142.06 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.418 0 CA-C-N 119.924 1.238 . . . . 0.0 111.391 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.1 m -94.41 -65.82 0.96 Allowed 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.773 -1.204 . . . . 0.0 112.892 165.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.0 m -78.77 112.5 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 CA-C-N 119.764 1.166 . . . . 0.0 111.748 176.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.9 t -83.26 77.86 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 CA-C-O 125.401 2.524 . . . . 0.0 111.355 -169.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.11 149.51 47.52 Favored 'General case' 0 CA--C 1.575 1.926 0 CA-C-N 111.276 -2.693 . . . . 0.0 115.354 -172.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TPO . . . . . 1.173 ' O1P' ' O ' ' A' ' 13' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.31 36.9 Cg_endo -84.81 -85.76 0.0 OUTLIER 'Trans proline' 0 CA--C 1.586 3.094 0 C-N-CA 123.702 2.935 . . . . 0.0 114.952 177.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -77.48 81.17 2.72 Favored 'Trans proline' 0 CA--C 1.57 2.312 0 CA-C-N 127.969 3.882 . . . . 0.0 112.809 173.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 151.84 44.63 Favored 'General case' 0 CA--C 1.57 1.728 0 N-CA-C 120.482 3.512 . . . . 0.0 120.482 -144.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.7 166.54 0.3 Allowed Pre-proline 0 CA--C 1.578 2.046 0 N-CA-C 115.991 1.849 . . . . 0.0 115.991 150.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -52.19 -48.71 20.34 Favored 'Trans proline' 0 CA--C 1.574 2.5 0 CA-C-N 123.491 2.283 . . . . 0.0 115.833 166.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 1.173 ' O ' ' O1P' ' A' ' 7' ' ' TPO . 13.5 t . . . . . 0 CA--C 1.57 1.74 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 154.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 55.2 pttt . . . . . 0 CA--C 1.573 1.843 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 pp -115.35 175.59 1.84 Allowed Pre-proline 0 CA--C 1.588 2.409 0 CA-C-O 118.513 -0.756 . . . . 0.0 112.167 159.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -80.0 158.57 23.95 Favored 'Trans proline' 0 CA--C 1.59 3.299 0 N-CA-C 122.218 3.892 . . . . 0.0 122.218 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -78.47 129.87 9.62 Favored 'Trans proline' 0 CA--C 1.564 2.017 0 C-N-CA 123.233 2.622 . . . . 0.0 112.735 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.22 25.96 20.05 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 117.975 1.95 . . . . 0.0 117.975 -162.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.273 26.0 m95 -113.82 164.4 13.8 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-N 119.804 1.802 . . . . 0.0 114.662 172.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -145.17 -154.58 0.55 Allowed 'General case' 0 CA--C 1.569 1.708 0 CA-C-O 122.397 1.094 . . . . 0.0 112.219 147.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -145.28 119.61 9.59 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.816 -1.177 . . . . 0.0 111.293 -160.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -139.76 115.38 10.05 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.263 -1.523 . . . . 0.0 111.486 -161.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 26.8 mtp -114.32 142.07 46.79 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 117.985 2.587 . . . . 0.0 117.985 -139.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.323 55.9 p 71.59 75.83 0.17 Allowed 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 117.56 2.429 . . . . 0.0 117.56 151.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 24.8 mtp180 -102.48 -13.44 17.23 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 164.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 72.1 m -144.23 -157.03 0.75 Allowed 'General case' 0 CA--C 1.581 2.16 0 O-C-N 119.957 -1.715 . . . . 0.0 109.643 163.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 74.3 p -71.37 88.53 0.88 Allowed 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.328 -2.107 . . . . 0.0 115.105 -174.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.23 46.0 45.29 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 116.122 1.209 . . . . 0.0 116.122 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -134.2 122.74 23.22 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 117.975 0.887 . . . . 0.0 110.414 -163.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.783 0.3 OUTLIER 85.84 129.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 C-N-CA 124.712 1.205 . . . . 0.0 112.892 -168.204 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -177.09 5.69 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.976 0 C-N-CA 126.508 1.923 . . . . 0.0 115.607 -162.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -146.51 142.53 28.15 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 123.303 2.774 . . . . 0.0 112.3 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -147.47 127.82 13.96 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.324 1.049 . . . . 0.0 110.558 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.54 122.49 37.18 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 120.118 -1.614 . . . . 0.0 111.213 172.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -76.36 -53.25 8.45 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 178.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -65.27 -45.9 92.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 89.6 m -61.5 -45.17 95.35 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.288 13.3 t30 82.76 65.55 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 125.706 1.602 . . . . 0.0 112.269 -170.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -143.73 112.41 6.54 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.601 0.715 . . . . 0.0 112.217 -173.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 76.1 p -80.88 134.88 35.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.99 -1.069 . . . . 0.0 113.591 163.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -161.56 157.97 25.61 Favored 'General case' 0 CA--C 1.564 1.5 0 CA-C-O 123.342 1.544 . . . . 0.0 113.867 -171.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.283 0.5 OUTLIER -101.01 42.54 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.748 -1.114 . . . . 0.0 113.528 160.112 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -132.18 139.5 48.4 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.472 1.13 . . . . 0.0 111.712 -170.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 -90.04 130.28 42.98 Favored Pre-proline 0 CA--C 1.577 1.993 0 CA-C-O 118.021 -0.99 . . . . 0.0 113.164 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.19 -37.19 93.17 Favored 'Trans proline' 0 CA--C 1.574 2.506 0 C-N-CA 122.713 2.276 . . . . 0.0 116.532 172.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t -82.54 -0.62 47.54 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 117.845 2.535 . . . . 0.0 117.845 167.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.11 62.64 0.54 Allowed Glycine 0 N--CA 1.502 3.055 0 O-C-N 119.805 -1.81 . . . . 0.0 115.342 155.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 60.1 t-20 -164.99 147.66 8.23 Favored 'General case' 0 CA--C 1.567 1.604 0 C-N-CA 123.422 0.689 . . . . 0.0 109.527 -153.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 66.1 m -61.3 -35.94 78.73 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 165.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 82.8 p -85.41 110.08 18.89 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 119.999 1.272 . . . . 0.0 112.699 162.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -134.2 133.6 41.09 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 114.115 -1.402 . . . . 0.0 109.713 166.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.067 0 O-C-N 121.587 -0.696 . . . . 0.0 113.885 -177.499 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.7 pttm . . . . . 0 CA--C 1.57 1.729 0 CA-C-O 118.948 -0.549 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.1 t -83.55 155.55 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 CA-C-N 119.113 0.869 . . . . 0.0 110.355 171.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.0 p -73.66 77.95 1.52 Allowed 'General case' 0 CA--C 1.575 1.912 0 O-C-N 120.582 -1.324 . . . . 0.0 113.085 165.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.471 13.5 t 68.21 -115.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 C-N-CA 123.85 0.86 . . . . 0.0 110.755 -170.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.3 t -135.76 129.23 48.11 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.815 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 167.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.1 124.85 18.25 Favored 'General case' 0 CA--C 1.575 1.926 0 O-C-N 120.358 -1.463 . . . . 0.0 111.483 -159.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.382 18.1 Cg_endo -60.66 -81.4 0.01 OUTLIER 'Trans proline' 0 CA--C 1.585 3.05 0 C-N-CA 123.246 2.631 . . . . 0.0 118.523 -159.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.0 154.06 42.21 Favored 'Trans proline' 0 CA--C 1.569 2.264 0 CA-C-N 126.627 3.403 . . . . 0.0 113.442 167.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.91 92.61 3.74 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.562 -1.336 . . . . 0.0 114.206 -172.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.0 m -79.84 172.56 9.55 Favored Pre-proline 0 CA--C 1.586 2.331 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 159.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -71.93 78.95 1.71 Allowed 'Trans proline' 0 CA--C 1.574 2.5 0 CA-C-N 124.021 2.472 . . . . 0.0 114.84 175.015 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 CA--C 1.562 1.406 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 -161.265 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 49.7 tttm . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pp -147.44 164.94 20.39 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 174.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -82.06 158.93 18.08 Favored 'Trans proline' 0 CA--C 1.587 3.127 0 N-CA-C 121.963 3.794 . . . . 0.0 121.963 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.07 113.56 2.74 Favored 'Trans proline' 0 CA--C 1.564 2.019 0 C-N-CA 123.357 2.704 . . . . 0.0 112.611 -175.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 24.16 5.66 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -163.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.281 24.1 m95 -115.36 162.59 16.91 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.559 1.68 . . . . 0.0 114.21 175.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 -151.01 0.35 Allowed 'General case' 0 CA--C 1.573 1.861 0 CA-C-O 121.838 0.828 . . . . 0.0 112.09 150.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.77 118.18 7.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.637 -1.29 . . . . 0.0 111.759 -160.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.7 mtt-85 -137.32 113.94 10.32 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 119.992 -1.692 . . . . 0.0 112.923 -159.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -120.47 121.0 37.51 Favored 'General case' 0 CA--C 1.563 1.463 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -130.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' B' ' 16' ' ' ARG 0.279 5.4 t 71.05 132.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 118.741 2.867 . . . . 0.0 118.741 163.697 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -124.87 -56.21 1.58 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.297 -1.502 . . . . 0.0 112.424 157.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 97.0 p -74.74 -43.04 57.02 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 58.1 m -158.47 -54.72 0.07 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.929 -1.107 . . . . 0.0 112.401 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -166.49 64.61 0.21 Allowed Glycine 0 N--CA 1.49 2.294 0 O-C-N 120.944 -1.097 . . . . 0.0 112.813 173.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.461 ' O ' ' HA ' ' B' ' 11' ' ' SER . 3.4 mpt_? -149.98 146.81 27.23 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.593 1.187 . . . . 0.0 112.636 -174.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.711 0.5 OUTLIER 79.73 130.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 120.882 -1.136 . . . . 0.0 112.641 -144.576 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.291 1.1 p90 -175.34 4.32 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.215 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -165.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -143.33 141.13 30.86 Favored 'General case' 0 N--CA 1.511 2.613 0 CA-C-N 122.772 2.533 . . . . 0.0 112.801 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -143.9 125.94 15.42 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.585 -1.322 . . . . 0.0 112.303 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.66 125.74 34.98 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.062 -1.649 . . . . 0.0 111.193 172.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -77.68 -50.93 11.45 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 175.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 24.4 mm -65.77 -46.38 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -62.54 -43.61 98.38 Favored 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 162.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.519 0.1 OUTLIER 75.79 74.85 0.09 Allowed 'General case' 0 CA--C 1.571 1.759 0 C-N-CA 125.656 1.583 . . . . 0.0 112.578 -163.588 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -141.43 109.59 5.85 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.017 -1.052 . . . . 0.0 111.263 -176.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p -82.23 126.25 31.88 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.541 -0.725 . . . . 0.0 112.822 166.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' GLN . . . . . 0.402 ' HG3' ' H ' ' B' ' 30' ' ' GLU . 7.0 pt20 -146.32 170.14 17.39 Favored 'General case' 0 CA--C 1.565 1.524 0 CA-C-O 123.76 1.743 . . . . 0.0 114.913 -178.088 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.31 1.9 p-90 -115.96 43.23 2.17 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 166.217 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.402 ' H ' ' HG3' ' B' ' 28' ' ' GLN . 0.0 OUTLIER -139.42 159.74 41.46 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 123.125 1.44 . . . . 0.0 110.516 162.659 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -90.48 142.71 28.38 Favored Pre-proline 0 CA--C 1.58 2.125 0 CA-C-N 114.829 -1.078 . . . . 0.0 112.469 166.387 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -60.15 -2.0 1.56 Allowed 'Trans proline' 0 CA--C 1.582 2.906 0 C-N-CA 123.589 2.859 . . . . 0.0 119.141 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.317 7.1 t 72.68 -65.01 0.37 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.81 61.47 1.94 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 116.854 1.502 . . . . 0.0 116.854 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -141.58 115.85 9.44 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 123.88 0.872 . . . . 0.0 109.227 175.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 84.0 p -83.52 78.59 9.64 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 176.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 38.8 m -152.21 115.03 4.61 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 122.57 1.176 . . . . 0.0 108.574 164.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 94.3 p -148.88 101.36 3.17 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.383 177.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 CA-C-O 118.9 -0.944 . . . . 0.0 111.397 -178.495 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.6 tttp . . . . . 0 N--CA 1.495 1.806 0 CA-C-O 119.198 -0.429 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.36 143.42 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 173.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.9 m -163.63 143.02 8.21 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.087 -1.008 . . . . 0.0 111.991 -175.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.9 p -76.29 94.87 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.023 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.0 t 65.58 106.1 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 C-N-CA 124.993 1.317 . . . . 0.0 112.64 170.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.0 162.47 13.21 Favored 'General case' 0 CA--C 1.573 1.836 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -166.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.336 30.6 Cg_endo -73.2 -79.92 0.01 OUTLIER 'Trans proline' 0 CA--C 1.586 3.087 0 N-CA-C 118.702 2.539 . . . . 0.0 118.702 -172.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -66.52 142.32 64.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 CA-C-N 126.854 3.484 . . . . 0.0 115.149 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -103.38 99.32 9.15 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -157.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -63.64 134.8 96.01 Favored Pre-proline 0 CA--C 1.585 2.305 0 CA-C-O 117.39 -1.291 . . . . 0.0 112.678 107.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -53.09 -60.54 0.68 Allowed 'Trans proline' 0 CA--C 1.57 2.297 0 C-N-CA 123.123 2.549 . . . . 0.0 116.203 -176.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.6 m . . . . . 0 N--CA 1.484 1.23 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 140.066 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 tptp . . . . . 0 N--CA 1.495 1.82 0 N-CA-C 111.025 0.009 . . . . 0.0 111.025 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.7 174.55 2.55 Favored Pre-proline 0 CA--C 1.589 2.452 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 165.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -72.92 157.08 51.95 Favored 'Trans proline' 0 CA--C 1.589 3.238 0 N-CA-C 121.782 3.724 . . . . 0.0 121.782 -174.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -72.21 135.01 24.04 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 C-N-CA 123.278 2.652 . . . . 0.0 113.123 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.7 27.77 45.45 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 118.821 2.289 . . . . 0.0 118.821 -165.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.28 23.1 m95 -111.3 162.53 14.91 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 120.004 1.902 . . . . 0.0 114.083 170.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.71 -155.15 0.59 Allowed 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 122.193 0.997 . . . . 0.0 112.505 149.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.33 120.37 10.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.913 -1.117 . . . . 0.0 111.567 -159.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.1 mtt-85 -136.66 115.74 12.43 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.24 -1.537 . . . . 0.0 113.338 -160.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.7 mtp -108.89 107.05 17.29 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -158.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' SER . . . . . 0.559 ' H ' ' HB ' ' B' ' 17' ' ' VAL 0.285 5.8 p 65.93 -163.1 0.25 Allowed 'General case' 0 CA--C 1.579 2.076 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 164.262 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -124.87 -75.18 0.6 Allowed 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.4 p -139.63 85.95 2.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 144.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 21.0 m -155.7 -27.69 0.1 Allowed 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 -158.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.19 44.32 7.61 Favored Glycine 0 N--CA 1.499 2.847 0 CA-C-N 121.213 1.824 . . . . 0.0 115.638 -170.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -137.57 172.5 12.87 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.494 1.118 . . . . 0.0 111.157 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.559 ' HB ' ' H ' ' B' ' 11' ' ' SER 0.535 2.2 t 71.82 141.44 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.58 2.122 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 160.949 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.279 3.0 p90 -170.39 10.48 0.02 OUTLIER 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 -171.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -148.86 145.52 27.52 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 123.183 2.719 . . . . 0.0 113.602 -176.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -151.7 127.2 10.05 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.899 -1.126 . . . . 0.0 111.135 177.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.6 126.66 40.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.216 -1.552 . . . . 0.0 111.003 170.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -79.14 -45.79 19.28 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mt -66.81 -51.78 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 124.302 1.041 . . . . 0.0 112.96 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 85.7 m -56.65 -46.13 81.22 Favored 'General case' 0 CA--C 1.577 2.018 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 163.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.523 0.0 OUTLIER 76.21 65.98 0.06 Allowed 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 125.462 1.505 . . . . 0.0 112.302 -163.72 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -125.09 122.7 37.95 Favored 'General case' 0 CA--C 1.557 1.222 0 O-C-N 121.185 -0.947 . . . . 0.0 110.418 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -99.69 121.43 41.22 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.973 -0.455 . . . . 0.0 110.937 167.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -153.51 171.1 19.24 Favored 'General case' 0 CA--C 1.562 1.407 0 CA-C-O 123.364 1.554 . . . . 0.0 113.21 -164.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.314 0.6 OUTLIER -127.11 51.1 1.91 Allowed 'General case' 0 CA--C 1.567 1.601 0 O-C-N 121.12 -0.988 . . . . 0.0 113.251 166.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -135.93 140.15 43.8 Favored 'General case' 0 CA--C 1.56 1.353 0 CA-C-O 122.238 1.018 . . . . 0.0 110.593 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 52.8 ttp85 -81.26 128.12 71.51 Favored Pre-proline 0 CA--C 1.576 1.961 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.83 171.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -61.25 6.5 0.14 Allowed 'Trans proline' 0 CA--C 1.581 2.843 0 N-CA-C 120.03 3.05 . . . . 0.0 120.03 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.384 37.7 p 78.77 -63.31 0.29 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -175.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.33 -73.47 0.51 Allowed Glycine 0 N--CA 1.493 2.442 0 CA-C-N 118.697 0.681 . . . . 0.0 113.573 -165.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -90.87 86.42 6.3 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.502 0.668 . . . . 0.0 110.274 171.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 44.1 t -84.99 65.38 9.21 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 79.8 p -90.47 104.88 17.41 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 122.39 1.09 . . . . 0.0 112.486 171.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 70.4 m -112.71 -58.83 2.09 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.433 -1.712 . . . . 0.0 112.484 174.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.55 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 176.234 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.5 tttp . . . . . 0 N--CA 1.497 1.888 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . 0.523 28.6 m 56.52 -95.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 CA-C-N 119.194 0.907 . . . . 0.0 112.211 -154.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . 0.373 82.2 p 70.14 -42.4 0.51 Allowed 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 120.844 3.646 . . . . 0.0 120.844 155.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 75.3 t -83.29 98.37 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 CA-C-N 120.61 1.55 . . . . 0.0 109.76 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.8 t -77.05 116.58 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 CA-C-O 122.036 0.922 . . . . 0.0 109.004 177.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 16.2 mtp-105 -97.16 145.44 26.02 Favored 'General case' 0 CA--C 1.568 1.636 0 CA-C-O 122.322 1.058 . . . . 0.0 113.782 -171.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.277 24.3 Cg_endo -62.12 -52.53 2.67 Favored 'Trans proline' 0 CA--C 1.575 2.566 0 C-N-CA 123.053 2.502 . . . . 0.0 117.265 -171.032 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.83 -103.26 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.666 0 CA-C-N 125.086 2.852 . . . . 0.0 112.267 162.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -161.47 171.02 18.87 Favored 'General case' 0 CA--C 1.577 1.994 0 CA-C-N 119.613 1.097 . . . . 0.0 112.014 167.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 76.2 p -49.99 155.94 1.45 Allowed Pre-proline 0 CA--C 1.582 2.203 0 N-CA-C 117.015 2.228 . . . . 0.0 117.015 157.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -60.05 -54.23 2.46 Favored 'Trans proline' 0 CA--C 1.572 2.383 0 CA-C-N 123.484 2.28 . . . . 0.0 115.915 173.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.2 p . . . . . 0 N--CA 1.486 1.368 0 C-N-CA 123.208 0.603 . . . . 0.0 112.122 158.048 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 10.5 pttp . . . . . 0 CA--C 1.576 1.956 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.3 171.07 10.52 Favored Pre-proline 0 CA--C 1.589 2.469 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 163.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -73.31 154.83 51.41 Favored 'Trans proline' 0 CA--C 1.59 3.306 0 N-CA-C 122.118 3.853 . . . . 0.0 122.118 -172.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -71.62 129.41 15.61 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.96 2.44 . . . . 0.0 113.009 173.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.64 7.84 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 117.322 1.689 . . . . 0.0 117.322 -160.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -123.4 169.87 10.92 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-N 120.362 2.081 . . . . 0.0 116.477 171.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.07 178.81 8.39 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-O 124.12 1.914 . . . . 0.0 111.836 144.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.271 0.2 OUTLIER -100.42 127.08 46.84 Favored 'General case' 0 CA--C 1.573 1.828 0 CA-C-N 114.135 -1.393 . . . . 0.0 112.406 169.188 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -129.61 126.19 37.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.228 -1.545 . . . . 0.0 109.699 -170.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 86.3 mmm -112.77 136.0 52.88 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -156.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' SER . . . . . 0.432 ' H ' ' HB ' ' B' ' 17' ' ' VAL 0.261 24.3 p 47.86 61.17 3.1 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 121.342 3.83 . . . . 0.0 121.342 137.5 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -71.31 -15.48 62.41 Favored 'General case' 0 CA--C 1.582 2.18 0 N-CA-C 117.325 2.343 . . . . 0.0 117.325 165.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -131.15 174.66 9.81 Favored 'General case' 0 CA--C 1.578 2.036 0 O-C-N 120.871 -1.143 . . . . 0.0 110.433 155.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 14.7 t -68.75 96.3 0.73 Allowed 'General case' 0 CA--C 1.57 1.729 0 N-CA-C 115.61 1.708 . . . . 0.0 115.61 -164.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.02 55.08 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 115.49 0.956 . . . . 0.0 115.49 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -141.19 163.73 32.18 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.12 0.968 . . . . 0.0 110.398 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.432 ' HB ' ' H ' ' B' ' 11' ' ' SER 0.483 1.6 t 66.23 132.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.579 2.089 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 162.345 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.337 6.5 p90 -165.8 2.57 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.82 0 O-C-N 119.717 -1.864 . . . . 0.0 116.016 -171.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -144.01 156.77 44.52 Favored 'General case' 0 N--CA 1.502 2.148 0 CA-C-N 122.793 2.542 . . . . 0.0 114.142 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -161.75 129.75 4.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.294 -1.504 . . . . 0.0 109.441 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -83.65 125.61 32.03 Favored 'General case' 0 CA--C 1.576 1.943 0 O-C-N 120.106 -1.621 . . . . 0.0 110.645 168.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.75 -45.36 15.76 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 25.4 pt -67.12 -33.5 63.52 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 69.9 p -74.43 -49.59 21.84 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 114.773 1.398 . . . . 0.0 114.773 158.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.329 0.8 OUTLIER 82.6 58.83 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.996 0 C-N-CA 125.93 1.692 . . . . 0.0 112.592 -163.791 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -117.91 123.69 46.43 Favored 'General case' 0 CA--C 1.563 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 111.265 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 28.0 m -88.91 134.03 34.1 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.311 -0.868 . . . . 0.0 112.646 175.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -147.61 172.05 14.63 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 123.73 1.728 . . . . 0.0 113.424 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -121.92 60.62 0.97 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.314 -1.491 . . . . 0.0 110.358 163.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -156.77 130.18 8.07 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-O 121.977 0.894 . . . . 0.0 111.28 -152.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 -93.77 132.78 29.08 Favored Pre-proline 0 CA--C 1.573 1.852 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.168 -175.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -64.76 11.11 0.12 Allowed 'Trans proline' 0 CA--C 1.58 2.782 0 N-CA-C 119.499 2.846 . . . . 0.0 119.499 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.32 9.7 t 73.6 -70.58 0.15 Allowed 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.89 -67.04 0.78 Allowed Glycine 0 N--CA 1.492 2.388 0 O-C-N 121.729 -0.607 . . . . 0.0 113.957 -157.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -84.73 123.64 30.62 Favored 'General case' 0 CA--C 1.571 1.781 0 O-C-N 122.482 -0.423 . . . . 0.0 112.018 170.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 25.6 t -107.51 34.24 3.62 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 168.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 51.1 m -151.11 114.49 4.84 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 119.99 -1.694 . . . . 0.0 109.092 157.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -140.97 -75.26 0.32 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.831 178.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 N-CA-C 109.716 -1.354 . . . . 0.0 109.716 -138.586 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 97.5 mttt . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 118.605 -0.712 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.4 p -149.5 140.39 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 CA-C-N 119.664 1.12 . . . . 0.0 110.461 -178.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.8 m -88.97 94.35 9.92 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.297 -0.877 . . . . 0.0 111.046 168.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.253 12.3 p -76.78 85.08 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -170.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.435 HG11 ' HD2' ' B' ' 9' ' ' ARG 0.258 13.6 t 71.49 119.08 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 C-N-CA 124.542 1.137 . . . . 0.0 110.063 -167.533 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -141.54 130.85 23.59 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.128 0.966 . . . . 0.0 112.607 -172.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TPO . . . . . 1.333 ' O3P' ' HB3' ' B' ' 16' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -63.33 -47.94 6.94 Favored 'Trans proline' 0 CA--C 1.575 2.555 0 C-N-CA 123.188 2.592 . . . . 0.0 118.804 -175.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.03 -63.68 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.282 0 CA-C-N 125.886 3.138 . . . . 0.0 115.532 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? -154.78 142.57 19.97 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.046 . . . . 0.0 112.127 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.8 m -56.07 143.99 60.86 Favored Pre-proline 0 CA--C 1.58 2.113 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 165.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . 0.351 0.3 OUTLIER 4.17 70.03 0.0 OUTLIER 'Trans proline' 0 CA--C 1.561 1.839 2 N-CA-C 123.911 4.543 . . . . 0.0 123.911 -148.609 . . . . . . . . 4 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.448 ' C ' HH21 ' B' ' 16' ' ' ARG . 37.7 t . . . . . 0 C--O 1.253 1.284 0 O-C-N 121.208 -0.933 . . . . 0.0 110.218 129.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 117.056 -1.45 . . . . 0.0 111.652 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.324 1.2 pp 47.82 175.76 0.01 OUTLIER Pre-proline 0 N--CA 1.51 2.559 0 N-CA-C 120.16 3.392 . . . . 0.0 120.16 175.906 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -78.94 158.05 27.3 Favored 'Trans proline' 0 CA--C 1.587 3.15 0 N-CA-C 122.126 3.856 . . . . 0.0 122.126 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.74 127.02 8.48 Favored 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 123.271 2.648 . . . . 0.0 113.133 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.21 23.82 16.14 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 118.095 1.998 . . . . 0.0 118.095 -163.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.283 22.1 m95 -119.52 169.28 10.19 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 120.87 2.335 . . . . 0.0 115.848 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -134.71 164.88 26.54 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 124.957 2.313 . . . . 0.0 113.731 151.156 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.33 123.89 30.08 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-N 112.783 -2.008 . . . . 0.0 110.177 142.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ARG . . . . . 0.611 ' O ' HG13 ' B' ' 17' ' ' VAL . 2.7 mtt-85 -122.77 102.38 8.0 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 121.684 2.038 . . . . 0.0 110.599 -173.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.43 115.18 29.7 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -155.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 26.5 p 67.7 131.29 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.611 2.449 . . . . 0.0 117.611 168.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.61 -68.92 0.56 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.587 -1.321 . . . . 0.0 107.643 160.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 88.8 p -93.88 111.16 22.82 Favored 'General case' 0 CA--C 1.572 1.815 0 O-C-N 120.819 -1.175 . . . . 0.0 112.706 166.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . 0.278 38.8 p 63.88 40.27 7.57 Favored 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 119.885 3.291 . . . . 0.0 119.885 169.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.73 33.11 38.86 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 117.244 1.658 . . . . 0.0 117.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 1.333 ' HB3' ' O3P' ' A' ' 7' ' ' TPO . 9.4 mpt_? -116.96 126.08 52.39 Favored 'General case' 0 CA--C 1.565 1.552 0 CA-C-N 118.487 1.143 . . . . 0.0 111.236 -171.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.611 HG13 ' O ' ' B' ' 9' ' ' ARG 0.846 0.7 OUTLIER 110.4 148.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.417 1.887 . . . . 0.0 114.565 -179.131 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.394 10.2 p90 -170.46 12.23 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.252 0 C-N-CA 126.272 1.829 . . . . 0.0 115.383 176.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -148.47 137.67 21.84 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 122.364 2.347 . . . . 0.0 111.986 165.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -143.02 135.45 27.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.637 -1.914 . . . . 0.0 110.844 173.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.22 120.55 31.47 Favored 'General case' 0 CA--C 1.57 1.739 0 O-C-N 120.203 -1.561 . . . . 0.0 110.536 169.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -76.7 -43.97 35.47 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 26.5 pt -71.64 -35.98 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 80.4 p -71.36 -50.76 29.0 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 159.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.317 34.7 t-20 83.72 64.74 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 126.115 1.766 . . . . 0.0 112.162 -163.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -128.49 118.75 23.6 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 123.514 0.726 . . . . 0.0 111.455 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 89.6 p -86.42 128.23 34.92 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -0.964 . . . . 0.0 113.301 171.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -137.72 177.8 7.59 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.031 1.396 . . . . 0.0 111.887 175.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.366 0.1 OUTLIER -128.74 47.09 2.5 Favored 'General case' 0 CA--C 1.571 1.785 0 O-C-N 119.794 -1.816 . . . . 0.0 114.097 164.092 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -147.56 160.38 42.7 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-O 125.329 2.49 . . . . 0.0 109.587 167.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.313 17.7 ttp-105 -64.53 155.87 79.56 Favored Pre-proline 0 CA--C 1.569 1.709 0 CA-C-N 112.842 -1.981 . . . . 0.0 116.239 171.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.21 65.7 1.46 Allowed 'Trans proline' 0 CA--C 1.573 2.429 0 C-N-CA 122.233 1.955 . . . . 0.0 112.258 154.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 58.4 m -53.02 -13.36 0.44 Allowed 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 119.841 3.275 . . . . 0.0 119.841 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -95.22 57.74 1.72 Allowed Glycine 0 N--CA 1.494 2.507 0 CA-C-N 119.387 0.994 . . . . 0.0 115.255 171.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -134.24 98.63 4.16 Favored 'General case' 0 CA--C 1.566 1.562 0 C-N-CA 123.058 0.543 . . . . 0.0 110.098 -172.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 22.7 t -79.59 161.29 26.02 Favored 'General case' 0 CA--C 1.571 1.772 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 176.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 64.9 m -89.8 62.44 5.74 Favored 'General case' 0 N--CA 1.503 2.211 0 CA-C-O 124.525 2.107 . . . . 0.0 114.243 169.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 80.3 p -171.92 -42.7 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 112.554 -2.112 . . . . 0.0 115.03 -162.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 N-CA-C 107.857 -2.097 . . . . 0.0 107.857 -133.204 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.2 tptp . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 118.882 -0.58 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.5 t -136.72 52.4 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 CA-C-N 119.692 1.133 . . . . 0.0 109.84 167.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.8 t -174.06 155.37 2.48 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.024 -1.672 . . . . 0.0 112.201 -174.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.318 3.3 t 75.75 127.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.349 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 162.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.0 t -116.86 128.41 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 C-N-CA 124.123 0.969 . . . . 0.0 109.075 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -135.65 159.43 41.64 Favored 'General case' 0 N--CA 1.504 2.266 0 N-CA-C 117.507 2.41 . . . . 0.0 117.507 -160.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TPO . . . . . 0.558 ' O2P' ' O ' ' A' ' 13' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -70.14 -63.53 0.04 OUTLIER 'Trans proline' 0 CA--C 1.578 2.698 0 C-N-CA 123.099 2.532 . . . . 0.0 117.497 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -72.86 92.5 0.79 Allowed 'Trans proline' 0 CA--C 1.566 2.082 0 CA-C-N 125.566 3.023 . . . . 0.0 111.589 171.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.71 104.02 0.1 Allowed 'General case' 0 CA--C 1.571 1.759 0 CA-C-N 113.519 -1.673 . . . . 0.0 114.664 -165.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.4 m -83.51 177.56 2.93 Favored Pre-proline 0 CA--C 1.581 2.157 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -168.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -54.66 -13.99 6.73 Favored 'Trans proline' 0 CA--C 1.577 2.63 0 N-CA-C 119.908 3.003 . . . . 0.0 119.908 167.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.558 ' O ' ' O2P' ' A' ' 7' ' ' TPO . 58.1 m . . . . . 0 N--CA 1.485 1.304 0 O-C-N 120.704 -1.248 . . . . 0.0 109.98 161.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? . . . . . 0 CA--C 1.572 1.814 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.87 169.17 10.23 Favored Pre-proline 0 CA--C 1.588 2.42 0 N-CA-C 116.363 1.986 . . . . 0.0 116.363 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -70.88 153.61 63.7 Favored 'Trans proline' 0 CA--C 1.588 3.191 0 N-CA-C 122.157 3.868 . . . . 0.0 122.157 -172.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.21 126.74 10.68 Favored 'Trans proline' 0 CA--C 1.566 2.096 0 C-N-CA 123.183 2.589 . . . . 0.0 112.664 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.89 28.36 10.17 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 -161.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.254 12.6 m95 -114.54 162.96 16.04 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.276 2.038 . . . . 0.0 114.072 171.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -153.92 141.38 19.74 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-O 123.285 1.517 . . . . 0.0 114.916 152.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.44 128.17 35.82 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 166.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -129.59 106.88 9.04 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-N 120.494 1.497 . . . . 0.0 111.441 -174.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 3.2 ttm -114.82 129.3 56.67 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -132.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.344 24.5 p 78.42 157.85 0.17 Allowed 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 154.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -151.42 -50.55 0.12 Allowed 'General case' 0 CA--C 1.57 1.748 0 C-N-CA 124.524 1.13 . . . . 0.0 112.318 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 93.2 p -100.16 -61.89 1.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.0 112.786 157.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 97.3 p -119.15 -59.49 1.84 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -163.52 45.28 0.32 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 116.863 1.505 . . . . 0.0 116.863 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.12 144.32 44.3 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.548 1.139 . . . . 0.0 113.303 169.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.731 0.5 OUTLIER 73.45 124.84 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 CA-C-N 115.274 -0.875 . . . . 0.0 112.416 -142.68 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.308 9.8 p90 -172.29 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.16 0 CA-C-O 116.08 -1.914 . . . . 0.0 114.841 -174.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -153.85 148.79 26.66 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 124.357 3.253 . . . . 0.0 115.591 174.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -161.48 136.55 7.44 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 125.903 1.681 . . . . 0.0 109.123 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.12 128.47 44.07 Favored 'General case' 0 CA--C 1.571 1.752 0 O-C-N 120.27 -1.519 . . . . 0.0 110.642 172.333 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -75.16 -55.83 5.33 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.162 -1.586 . . . . 0.0 114.163 174.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -60.64 -35.16 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.36 -17.42 23.57 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 164.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.326 3.0 t-20 64.59 24.44 13.02 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 -164.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.54 150.73 43.27 Favored 'General case' 0 CA--C 1.573 1.863 0 O-C-N 119.599 -1.938 . . . . 0.0 114.273 164.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.4 m -152.56 122.09 6.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.964 -1.71 . . . . 0.0 111.2 -170.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -162.55 177.08 9.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 124.051 1.882 . . . . 0.0 112.952 -150.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.273 0.1 OUTLIER -119.01 39.44 3.54 Favored 'General case' 0 CA--C 1.577 1.995 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.824 155.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -127.13 134.14 50.25 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 122.394 1.093 . . . . 0.0 110.396 -167.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -90.56 123.97 63.84 Favored Pre-proline 0 CA--C 1.574 1.903 0 CA-C-O 117.897 -1.049 . . . . 0.0 113.512 -172.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -60.02 -39.83 66.89 Favored 'Trans proline' 0 CA--C 1.569 2.261 0 N-CA-C 117.845 2.21 . . . . 0.0 117.845 171.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.34 1.2 m 86.18 -49.81 0.06 Allowed 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 125.134 1.374 . . . . 0.0 114.606 -165.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.95 -75.06 2.43 Favored Glycine 0 N--CA 1.495 2.601 0 N-CA-C 116.576 1.39 . . . . 0.0 116.576 -177.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -75.8 -13.02 60.28 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 118.086 2.625 . . . . 0.0 118.086 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . 0.266 10.9 t 58.8 23.1 10.86 Favored 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 119.132 3.012 . . . . 0.0 119.132 -174.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 52.5 m -152.46 112.45 4.0 Favored 'General case' 0 CA--C 1.562 1.404 0 O-C-N 120.453 -1.404 . . . . 0.0 107.934 160.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 85.7 p -163.0 -52.36 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 114.265 -1.334 . . . . 0.0 113.891 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -141.362 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 118.85 -0.595 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -76.46 140.16 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.22 0 CA-C-N 120.0 1.273 . . . . 0.0 113.734 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m -106.37 77.86 1.24 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 120.685 -1.259 . . . . 0.0 111.191 167.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.7 p -80.85 105.03 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.892 0 C-N-CA 123.737 0.815 . . . . 0.0 111.883 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.333 2.4 t 73.6 111.86 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 C-N-CA 124.338 1.055 . . . . 0.0 110.906 -173.661 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.264 24.2 ptt-85 -146.43 -166.2 2.42 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 119.878 -1.763 . . . . 0.0 115.759 -156.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.293 18.1 Cg_endo -71.62 -68.53 0.02 OUTLIER 'Trans proline' 0 CA--C 1.582 2.912 0 N-CA-C 119.548 2.865 . . . . 0.0 119.548 -175.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -70.37 -49.31 0.48 Allowed 'Trans proline' 0 CA--C 1.567 2.127 0 CA-C-N 126.187 3.245 . . . . 0.0 117.487 -174.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.42 162.17 41.31 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.912 -1.118 . . . . 0.0 111.912 165.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.5 t -36.69 149.06 0.17 Allowed Pre-proline 0 CA--C 1.594 2.654 0 N-CA-C 120.851 3.649 . . . . 0.0 120.851 178.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -66.73 -33.71 33.9 Favored 'Trans proline' 0 CA--C 1.57 2.298 0 C-N-CA 123.441 2.761 . . . . 0.0 117.256 173.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.8 m . . . . . 0 N--CA 1.488 1.433 0 O-C-N 121.618 -0.676 . . . . 0.0 110.254 150.49 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 20.4 tptm . . . . . 0 CA--C 1.577 2.006 0 CA-C-O 120.941 0.401 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -144.59 176.28 2.33 Favored Pre-proline 0 CA--C 1.587 2.38 0 C-N-CA 124.471 1.109 . . . . 0.0 109.485 164.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -76.13 157.32 38.07 Favored 'Trans proline' 0 CA--C 1.584 3.016 0 N-CA-C 121.21 3.504 . . . . 0.0 121.21 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -79.19 124.33 5.95 Favored 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.117 2.545 . . . . 0.0 112.879 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.39 30.7 9.62 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 117.944 1.937 . . . . 0.0 117.944 -164.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' TRP . . . . . 0.504 ' CZ2' ' HG3' ' B' ' 32' ' ' PRO 0.268 22.4 m95 -114.13 162.82 16.02 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.506 1.653 . . . . 0.0 114.102 170.663 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -147.75 -148.62 0.26 Allowed 'General case' 0 CA--C 1.573 1.83 0 CA-C-O 121.93 0.871 . . . . 0.0 112.468 149.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.77 118.24 9.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.76 -1.212 . . . . 0.0 111.157 -161.273 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 mtt-85 -140.75 121.72 14.58 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.184 -1.573 . . . . 0.0 112.075 -161.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.5 mtp -113.18 142.33 45.9 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 118.355 2.724 . . . . 0.0 118.355 -150.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.301 46.7 m 65.57 62.11 0.67 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 118.495 2.776 . . . . 0.0 118.495 155.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ARG . . . . . 0.463 ' H ' HG12 ' B' ' 17' ' ' VAL . 16.0 mtp180 -65.75 -29.26 69.75 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 156.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 74.9 m -133.63 136.78 45.04 Favored 'General case' 0 CA--C 1.563 1.469 0 O-C-N 120.477 -1.39 . . . . 0.0 108.588 156.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 49.9 m -35.23 102.26 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 119.068 2.988 . . . . 0.0 119.068 -165.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 99.18 -0.4 57.27 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 119.047 2.379 . . . . 0.0 119.047 -173.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? -127.59 128.15 45.08 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 120.484 2.142 . . . . 0.0 112.371 -166.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.463 HG12 ' H ' ' B' ' 12' ' ' ARG 0.82 0.3 OUTLIER 99.46 135.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 C-N-CA 125.892 1.677 . . . . 0.0 112.217 -160.199 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.3 2.5 p90 -173.74 9.49 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.325 0 C-N-CA 126.184 1.794 . . . . 0.0 115.712 -170.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -147.27 144.92 29.19 Favored 'General case' 0 N--CA 1.511 2.603 0 CA-C-N 122.673 2.488 . . . . 0.0 112.982 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -152.89 129.79 10.98 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.137 -1.602 . . . . 0.0 112.666 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.71 125.04 37.15 Favored 'General case' 0 CA--C 1.573 1.831 0 O-C-N 120.197 -1.564 . . . . 0.0 111.063 168.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 -68.6 -42.5 78.07 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 9.0 mt -71.4 -54.84 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.166 0.986 . . . . 0.0 112.763 -171.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' THR . . . . . 0.589 HG23 ' H ' ' B' ' 26' ' ' ALA . 9.1 t -81.33 -15.98 53.74 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 171.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.285 6.4 t-20 61.9 17.47 8.94 Favored 'General case' 0 CA--C 1.582 2.193 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 -160.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ALA . . . . . 0.589 ' H ' HG23 ' B' ' 24' ' ' THR . . . -58.9 96.85 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 O-C-N 119.874 -1.766 . . . . 0.0 113.29 162.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 9.3 m -113.59 122.75 48.15 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -170.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.86 163.69 38.91 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 124.154 1.931 . . . . 0.0 115.074 -154.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -102.42 49.12 0.85 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 113.846 -1.524 . . . . 0.0 112.378 168.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -161.04 138.77 9.33 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 123.092 1.425 . . . . 0.0 111.045 -148.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 68.8 ttt-85 -107.33 112.54 62.67 Favored Pre-proline 0 CA--C 1.573 1.839 0 CA-C-O 117.772 -1.109 . . . . 0.0 112.884 -155.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' PRO . . . . . 0.504 ' HG3' ' CZ2' ' B' ' 6' ' ' TRP . 39.2 Cg_endo -68.36 -48.5 1.17 Allowed 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 122.408 2.072 . . . . 0.0 115.335 174.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t 69.31 -47.97 0.59 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 118.828 2.899 . . . . 0.0 118.828 177.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.24 -53.01 4.4 Favored Glycine 0 N--CA 1.495 2.604 0 O-C-N 120.715 -1.241 . . . . 0.0 115.848 -164.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -123.35 132.2 53.9 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 161.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . 0.343 45.5 m 124.87 -68.23 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.426 0 C-N-CA 127.554 2.342 . . . . 0.0 110.896 -168.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 38.2 m -87.57 61.58 6.61 Favored 'General case' 0 N--CA 1.504 2.261 0 CA-C-O 124.508 2.099 . . . . 0.0 113.068 176.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 15.1 t 170.23 -60.91 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.72 -2.036 . . . . 0.0 110.326 -145.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 107.387 -2.285 . . . . 0.0 107.387 -131.909 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? . . . . . 0 CA--C 1.576 1.979 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 84.1 t -83.82 140.33 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 CA-C-O 122.161 0.982 . . . . 0.0 112.306 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.0 t -132.61 85.42 2.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.005 -1.059 . . . . 0.0 108.782 160.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.296 22.3 t 73.05 141.35 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 C-N-CA 124.381 1.073 . . . . 0.0 111.578 -164.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.6 t -82.8 80.59 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.305 0 O-C-N 119.517 -1.989 . . . . 0.0 110.132 170.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.14 170.06 9.39 Favored 'General case' 0 CA--C 1.574 1.888 0 CA-C-N 113.435 -1.711 . . . . 0.0 115.099 -172.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.253 6.3 Cg_exo -64.6 -59.18 0.18 Allowed 'Trans proline' 0 CA--C 1.573 2.442 0 C-N-CA 123.325 2.684 . . . . 0.0 118.524 169.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -80.25 -111.61 0.01 OUTLIER 'Trans proline' 0 CA--C 1.572 2.397 0 CA-C-N 125.343 2.944 . . . . 0.0 112.507 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.39 102.77 3.63 Favored 'General case' 0 CA--C 1.568 1.648 0 O-C-N 120.317 -1.489 . . . . 0.0 110.388 172.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.256 89.3 p -35.51 168.65 0.02 OUTLIER Pre-proline 0 CA--C 1.587 2.373 0 N-CA-C 119.001 2.963 . . . . 0.0 119.001 113.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -56.98 -63.28 0.17 Allowed 'Trans proline' 0 CA--C 1.578 2.682 0 CA-C-N 123.925 2.438 . . . . 0.0 114.499 158.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 N--CA 1.487 1.376 0 C-N-CA 123.829 0.851 . . . . 0.0 112.314 170.208 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? . . . . . 0 CA--C 1.57 1.736 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -63.08 170.82 2.35 Favored Pre-proline 0 CA--C 1.586 2.364 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . 0.25 33.6 Cg_exo -68.1 155.6 68.93 Favored 'Trans proline' 0 CA--C 1.593 3.44 0 N-CA-C 122.45 3.981 . . . . 0.0 122.45 -172.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -73.41 135.73 22.79 Favored 'Trans proline' 0 CA--C 1.563 1.975 0 C-N-CA 123.311 2.674 . . . . 0.0 112.694 175.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.06 32.15 26.91 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 -161.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.261 17.1 m95 -116.68 162.44 17.65 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 120.589 2.195 . . . . 0.0 114.521 170.209 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.95 -148.1 0.24 Allowed 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.966 0.889 . . . . 0.0 111.671 150.066 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -149.49 118.93 6.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.227 -1.546 . . . . 0.0 110.415 -163.121 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -137.93 115.48 11.26 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.098 -1.626 . . . . 0.0 114.449 -161.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' MET . . . . . 0.407 ' HA ' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -101.11 114.04 27.62 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -152.551 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 78.9 p 46.7 87.33 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 119.998 3.332 . . . . 0.0 119.998 169.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . 0.256 0.0 OUTLIER -56.03 -40.49 73.53 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 173.005 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 84.9 p -160.6 55.49 0.32 Allowed 'General case' 0 CA--C 1.576 1.974 0 C-N-CA 124.283 1.033 . . . . 0.0 111.584 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -164.82 -114.34 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.399 -1.438 . . . . 0.0 109.809 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -161.33 26.69 0.27 Allowed Glycine 0 N--CA 1.498 2.816 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 172.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -138.47 170.7 15.56 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 125.019 1.327 . . . . 0.0 109.408 171.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 10' ' ' MET 0.809 0.3 OUTLIER 93.31 131.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 120.774 -1.204 . . . . 0.0 111.723 -156.543 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.339 1.4 p90 -177.83 8.73 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.477 0 C-N-CA 126.084 1.754 . . . . 0.0 114.606 -167.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -136.12 137.44 41.01 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 119.185 -2.197 . . . . 0.0 109.373 174.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -140.12 130.28 25.04 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 119.509 -1.994 . . . . 0.0 112.922 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.63 129.7 39.81 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.091 -1.631 . . . . 0.0 111.149 171.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -82.69 -53.56 5.82 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 175.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 31.1 pt -62.94 -50.0 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 94.5 m -58.17 -42.3 85.71 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 158.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.314 11.5 t-20 77.5 73.02 0.06 Allowed 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 125.763 1.625 . . . . 0.0 109.433 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -152.0 134.56 15.38 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.535 -0.728 . . . . 0.0 111.811 -169.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 92.5 p -86.62 131.7 34.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.023 -1.048 . . . . 0.0 112.555 161.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.274 1.3 pt20 -133.68 161.72 33.89 Favored 'General case' 0 CA--C 1.566 1.571 0 CA-C-O 122.573 1.177 . . . . 0.0 112.682 167.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.276 0.1 OUTLIER -108.87 19.61 19.42 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 170.235 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -157.56 38.89 0.28 Allowed 'General case' 0 CA--C 1.567 1.607 0 N-CA-C 119.869 3.285 . . . . 0.0 119.869 -171.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 54.28 142.67 0.03 OUTLIER Pre-proline 0 CA--C 1.59 2.493 0 N-CA-C 121.393 3.849 . . . . 0.0 121.393 166.379 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -69.45 3.24 2.74 Favored 'Trans proline' 0 CA--C 1.578 2.684 0 N-CA-C 118.36 2.408 . . . . 0.0 118.36 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.358 8.6 m 78.07 -47.72 0.46 Allowed 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 -172.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.9 80.28 0.35 Allowed Glycine 0 N--CA 1.5 2.957 0 CA-C-N 120.411 1.46 . . . . 0.0 116.014 176.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -132.04 -44.66 0.95 Allowed 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -166.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 11.1 t -73.61 -10.55 59.82 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 119.002 2.964 . . . . 0.0 119.002 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 44.4 p -71.14 114.81 9.58 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 121.241 1.837 . . . . 0.0 111.408 158.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 3.7 t -144.17 -83.3 0.15 Allowed 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 114.906 -1.043 . . . . 0.0 111.081 -164.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.6 0 C-N-CA 118.04 -2.029 . . . . 0.0 110.101 -119.387 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 N--CA 1.499 1.985 0 CA-C-O 121.971 0.891 . . . . 0.0 109.081 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 122.598 1.19 . . . . 0.0 113.555 -172.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.294 9.7 Cg_endo . . . . . 0 CA--C 1.578 2.694 0 N-CA-C 117.89 2.227 . . . . 0.0 117.89 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -83.06 -117.62 0.01 OUTLIER 'Trans proline' 0 CA--C 1.582 2.915 0 CA-C-N 123.987 2.46 . . . . 0.0 111.885 162.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.4 pttp . . . . . 0 CA--C 1.576 1.95 0 O-C-N 120.202 -1.561 . . . . 0.0 111.244 164.876 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 CA--C 1.581 2.162 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pp -74.71 171.66 10.94 Favored Pre-proline 0 CA--C 1.589 2.477 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -72.79 156.27 53.11 Favored 'Trans proline' 0 CA--C 1.586 3.107 0 N-CA-C 121.958 3.792 . . . . 0.0 121.958 -174.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.28 129.26 15.72 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 C-N-CA 123.029 2.486 . . . . 0.0 113.605 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.95 28.82 24.87 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 118.578 2.191 . . . . 0.0 118.578 -167.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.251 16.5 m95 -109.76 177.09 4.83 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 120.241 2.021 . . . . 0.0 116.352 173.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -148.56 162.36 39.81 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-O 124.122 1.915 . . . . 0.0 111.081 147.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.254 0.1 OUTLIER -101.14 116.75 33.54 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.541 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -101.05 160.23 14.55 Favored 'General case' 0 CA--C 1.557 1.224 0 O-C-N 120.093 -1.63 . . . . 0.0 107.98 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.18 125.04 13.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -173.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.292 20.7 p 74.99 146.63 0.09 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 119.047 2.98 . . . . 0.0 119.047 157.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 39.8 mtm-85 -130.0 -68.64 0.7 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.91 -1.119 . . . . 0.0 110.11 162.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 96.2 p -115.68 -70.65 0.78 Allowed 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 119.194 0.907 . . . . 0.0 111.941 170.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 34.0 t -72.18 1.98 6.66 Favored 'General case' 0 CA--C 1.579 2.096 0 N-CA-C 119.227 3.047 . . . . 0.0 119.227 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.66 54.61 1.91 Allowed Glycine 0 N--CA 1.489 2.169 0 CA-C-N 120.704 1.593 . . . . 0.0 113.628 -177.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -136.29 137.77 41.05 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 123.207 1.479 . . . . 0.0 113.676 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.434 HG22 ' H ' ' B' ' 18' ' ' TYR 0.802 1.1 p 135.1 148.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 C-N-CA 129.239 3.016 . . . . 0.0 111.642 177.723 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.434 ' H ' HG22 ' B' ' 17' ' ' VAL 0.345 52.4 m-85 -135.95 -48.2 0.67 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -159.05 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -155.38 146.82 22.91 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 123.11 1.433 . . . . 0.0 113.615 -160.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -151.42 122.53 7.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.512 -1.367 . . . . 0.0 108.55 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.35 124.24 27.6 Favored 'General case' 0 CA--C 1.57 1.744 0 O-C-N 119.736 -1.852 . . . . 0.0 110.833 174.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.33 -46.82 11.37 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -175.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.5 pt -61.82 -45.09 99.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.281 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 172.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 55.3 m -66.58 -48.11 70.63 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 165.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.343 53.4 m-80 77.97 68.41 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.673 0 C-N-CA 126.499 1.92 . . . . 0.0 112.656 -166.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -137.71 124.5 21.16 Favored 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.777 0.831 . . . . 0.0 110.739 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 37.4 m -83.39 142.26 31.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.377 -0.827 . . . . 0.0 112.892 172.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.27 10.1 pt20 -148.17 173.42 12.99 Favored 'General case' 0 CA--C 1.562 1.426 0 CA-C-O 123.58 1.657 . . . . 0.0 113.305 166.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.305 0.1 OUTLIER -111.33 39.69 2.25 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 169.297 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.11 160.1 40.71 Favored 'General case' 0 CA--C 1.563 1.472 0 CA-C-O 123.728 1.727 . . . . 0.0 111.228 174.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.25 15.2 ttt85 -54.2 157.49 4.56 Favored Pre-proline 0 CA--C 1.585 2.314 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 159.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -60.52 17.9 0.04 OUTLIER 'Trans proline' 0 CA--C 1.584 3.02 0 N-CA-C 119.173 2.72 . . . . 0.0 119.173 164.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.322 8.4 t . . . . . 0 N--CA 1.492 1.674 0 C-N-CA 125.538 1.535 . . . . 0.0 114.253 -172.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.302 3.4 t . . . . . 0 N--CA 1.503 2.199 0 CA-C-O 122.147 0.975 . . . . 0.0 109.797 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 35.0 ttp85 . . . . . 0 N--CA 1.496 1.835 0 O-C-N 120.969 -1.082 . . . . 0.0 113.471 -168.631 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.282 13.4 Cg_endo . . . . . 0 CA--C 1.585 3.052 0 N-CA-C 116.805 1.81 . . . . 0.0 116.805 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -80.06 -111.37 0.01 OUTLIER 'Trans proline' 0 CA--C 1.578 2.704 0 CA-C-N 125.018 2.828 . . . . 0.0 112.942 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.0 pttt . . . . . 0 CA--C 1.573 1.841 0 O-C-N 120.546 -1.347 . . . . 0.0 112.194 167.732 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.584 2.255 0 N-CA-C 118.071 2.619 . . . . 0.0 118.071 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.372 0.6 OUTLIER 50.41 163.62 0.04 OUTLIER Pre-proline 0 CA--C 1.59 2.481 0 N-CA-C 118.205 2.668 . . . . 0.0 118.205 -157.313 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -77.72 156.02 31.34 Favored 'Trans proline' 0 CA--C 1.591 3.366 0 N-CA-C 121.927 3.78 . . . . 0.0 121.927 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.34 130.54 15.23 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.135 2.556 . . . . 0.0 112.648 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.72 25.74 17.04 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 118.017 1.967 . . . . 0.0 118.017 -161.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.276 26.5 m95 -117.61 171.46 8.01 Favored 'General case' 0 CA--C 1.561 1.398 0 CA-C-N 120.387 2.094 . . . . 0.0 115.856 172.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -157.55 137.18 12.16 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 122.454 1.121 . . . . 0.0 113.187 147.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.67 127.53 32.76 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 174.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 14.8 mtt-85 -137.07 111.62 8.65 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.996 -1.69 . . . . 0.0 110.737 -167.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 28.7 mtp -114.6 141.76 47.34 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 116.906 2.188 . . . . 0.0 116.906 -138.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.266 54.3 p 60.68 64.99 1.09 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 137.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 62.1 mtm180 -88.63 -12.18 43.25 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 68.9 m -144.64 -112.29 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.483 -1.386 . . . . 0.0 108.255 166.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 48.2 m -86.48 56.56 4.05 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 121.45 1.932 . . . . 0.0 115.176 -175.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.5 53.3 6.07 Favored Glycine 0 N--CA 1.489 2.174 0 O-C-N 120.514 -1.366 . . . . 0.0 114.719 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -132.8 144.47 50.26 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 122.259 1.028 . . . . 0.0 112.191 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.678 0.5 OUTLIER 73.27 135.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -159.113 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.351 1.9 p90 -175.02 7.07 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.311 0 C-N-CA 126.281 1.833 . . . . 0.0 114.905 -169.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -146.49 148.11 31.89 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 122.42 2.373 . . . . 0.0 112.76 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -150.58 123.37 8.64 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.112 -1.617 . . . . 0.0 108.199 173.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.28 126.1 33.43 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 119.959 -1.713 . . . . 0.0 110.641 172.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -88.17 -46.68 9.06 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.297 1.962 . . . . 0.0 116.297 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 33.5 pt -58.93 -40.26 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 56.4 m -71.55 -45.48 62.21 Favored 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 160.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.327 6.2 t30 79.04 67.91 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 125.838 1.655 . . . . 0.0 112.366 -169.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -142.38 122.65 13.88 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.391 0.676 . . . . 0.0 111.641 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 79.4 p -81.04 134.15 35.62 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -153.4 167.6 28.87 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.259 0.2 OUTLIER -113.3 36.92 3.35 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-N 113.622 -1.626 . . . . 0.0 114.986 169.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -148.14 157.4 43.48 Favored 'General case' 0 CA--C 1.571 1.767 0 CA-C-O 125.588 2.613 . . . . 0.0 111.408 167.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.341 18.7 ttp-105 -69.05 150.98 97.41 Favored Pre-proline 0 CA--C 1.58 2.13 0 CA-C-N 112.09 -2.323 . . . . 0.0 115.655 174.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.34 -35.92 98.89 Favored 'Trans proline' 0 CA--C 1.57 2.278 0 C-N-CA 122.614 2.209 . . . . 0.0 117.083 168.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.314 1.6 t . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 165.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.9 t . . . . . 0 N--CA 1.505 2.276 0 CA-C-O 125.401 2.524 . . . . 0.0 111.355 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.575 1.926 0 CA-C-N 111.276 -2.693 . . . . 0.0 115.354 -172.105 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.31 36.9 Cg_endo . . . . . 0 CA--C 1.586 3.094 0 CA-C-O 114.292 -2.462 . . . . 0.0 114.952 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -77.48 81.17 2.72 Favored 'Trans proline' 0 CA--C 1.57 2.312 0 CA-C-N 127.969 3.882 . . . . 0.0 112.809 173.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.57 1.728 0 N-CA-C 120.482 3.512 . . . . 0.0 120.482 -144.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 55.2 pttt . . . . . 0 CA--C 1.573 1.843 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 pp -115.35 175.59 1.84 Allowed Pre-proline 0 CA--C 1.588 2.409 0 CA-C-O 118.513 -0.756 . . . . 0.0 112.167 159.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -80.0 158.57 23.95 Favored 'Trans proline' 0 CA--C 1.59 3.299 0 N-CA-C 122.218 3.892 . . . . 0.0 122.218 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -78.47 129.87 9.62 Favored 'Trans proline' 0 CA--C 1.564 2.017 0 C-N-CA 123.233 2.622 . . . . 0.0 112.735 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.22 25.96 20.05 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 117.975 1.95 . . . . 0.0 117.975 -162.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.273 26.0 m95 -113.82 164.4 13.8 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-N 119.804 1.802 . . . . 0.0 114.662 172.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -145.17 -154.58 0.55 Allowed 'General case' 0 CA--C 1.569 1.708 0 CA-C-O 122.397 1.094 . . . . 0.0 112.219 147.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -145.28 119.61 9.59 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.816 -1.177 . . . . 0.0 111.293 -160.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -139.76 115.38 10.05 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.263 -1.523 . . . . 0.0 111.486 -161.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 26.8 mtp -114.32 142.07 46.79 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 117.985 2.587 . . . . 0.0 117.985 -139.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.323 55.9 p 71.59 75.83 0.17 Allowed 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 117.56 2.429 . . . . 0.0 117.56 151.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 24.8 mtp180 -102.48 -13.44 17.23 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 164.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 72.1 m -144.23 -157.03 0.75 Allowed 'General case' 0 CA--C 1.581 2.16 0 O-C-N 119.957 -1.715 . . . . 0.0 109.643 163.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 74.3 p -71.37 88.53 0.88 Allowed 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.328 -2.107 . . . . 0.0 115.105 -174.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.23 46.0 45.29 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 116.122 1.209 . . . . 0.0 116.122 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -134.2 122.74 23.22 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 117.975 0.887 . . . . 0.0 110.414 -163.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.783 0.3 OUTLIER 85.84 129.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 C-N-CA 124.712 1.205 . . . . 0.0 112.892 -168.204 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -177.09 5.69 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.976 0 C-N-CA 126.508 1.923 . . . . 0.0 115.607 -162.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -146.51 142.53 28.15 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 123.303 2.774 . . . . 0.0 112.3 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -147.47 127.82 13.96 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.324 1.049 . . . . 0.0 110.558 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.54 122.49 37.18 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 120.118 -1.614 . . . . 0.0 111.213 172.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -76.36 -53.25 8.45 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 178.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -65.27 -45.9 92.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 89.6 m -61.5 -45.17 95.35 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.288 13.3 t30 82.76 65.55 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 125.706 1.602 . . . . 0.0 112.269 -170.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -143.73 112.41 6.54 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.601 0.715 . . . . 0.0 112.217 -173.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 76.1 p -80.88 134.88 35.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.99 -1.069 . . . . 0.0 113.591 163.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -161.56 157.97 25.61 Favored 'General case' 0 CA--C 1.564 1.5 0 CA-C-O 123.342 1.544 . . . . 0.0 113.867 -171.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.283 0.5 OUTLIER -101.01 42.54 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.748 -1.114 . . . . 0.0 113.528 160.112 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -132.18 139.5 48.4 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.472 1.13 . . . . 0.0 111.712 -170.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 -90.04 130.28 42.98 Favored Pre-proline 0 CA--C 1.577 1.993 0 CA-C-O 118.021 -0.99 . . . . 0.0 113.164 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.19 -37.19 93.17 Favored 'Trans proline' 0 CA--C 1.574 2.506 0 C-N-CA 122.713 2.276 . . . . 0.0 116.532 172.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t . . . . . 0 N--CA 1.499 2.002 0 N-CA-C 117.845 2.535 . . . . 0.0 117.845 167.168 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.3 t . . . . . 0 CA--C 1.572 1.815 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.575 1.926 0 O-C-N 120.358 -1.463 . . . . 0.0 111.483 -159.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.382 18.1 Cg_endo . . . . . 0 CA--C 1.585 3.05 0 N-CA-C 118.523 2.471 . . . . 0.0 118.523 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.0 154.06 42.21 Favored 'Trans proline' 0 CA--C 1.569 2.264 0 CA-C-N 126.627 3.403 . . . . 0.0 113.442 167.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.705 0 O-C-N 120.562 -1.336 . . . . 0.0 114.206 -172.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 49.7 tttm . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pp -147.44 164.94 20.39 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 174.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -82.06 158.93 18.08 Favored 'Trans proline' 0 CA--C 1.587 3.127 0 N-CA-C 121.963 3.794 . . . . 0.0 121.963 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.07 113.56 2.74 Favored 'Trans proline' 0 CA--C 1.564 2.019 0 C-N-CA 123.357 2.704 . . . . 0.0 112.611 -175.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 24.16 5.66 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -163.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.281 24.1 m95 -115.36 162.59 16.91 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.559 1.68 . . . . 0.0 114.21 175.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 -151.01 0.35 Allowed 'General case' 0 CA--C 1.573 1.861 0 CA-C-O 121.838 0.828 . . . . 0.0 112.09 150.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.77 118.18 7.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.637 -1.29 . . . . 0.0 111.759 -160.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.7 mtt-85 -137.32 113.94 10.32 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 119.992 -1.692 . . . . 0.0 112.923 -159.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -120.47 121.0 37.51 Favored 'General case' 0 CA--C 1.563 1.463 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -130.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' B' ' 16' ' ' ARG 0.279 5.4 t 71.05 132.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 118.741 2.867 . . . . 0.0 118.741 163.697 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -124.87 -56.21 1.58 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.297 -1.502 . . . . 0.0 112.424 157.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 97.0 p -74.74 -43.04 57.02 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 58.1 m -158.47 -54.72 0.07 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.929 -1.107 . . . . 0.0 112.401 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -166.49 64.61 0.21 Allowed Glycine 0 N--CA 1.49 2.294 0 O-C-N 120.944 -1.097 . . . . 0.0 112.813 173.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.461 ' O ' ' HA ' ' B' ' 11' ' ' SER . 3.4 mpt_? -149.98 146.81 27.23 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.593 1.187 . . . . 0.0 112.636 -174.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.711 0.5 OUTLIER 79.73 130.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 120.882 -1.136 . . . . 0.0 112.641 -144.576 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.291 1.1 p90 -175.34 4.32 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.215 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -165.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -143.33 141.13 30.86 Favored 'General case' 0 N--CA 1.511 2.613 0 CA-C-N 122.772 2.533 . . . . 0.0 112.801 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -143.9 125.94 15.42 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.585 -1.322 . . . . 0.0 112.303 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.66 125.74 34.98 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.062 -1.649 . . . . 0.0 111.193 172.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -77.68 -50.93 11.45 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 175.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 24.4 mm -65.77 -46.38 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -62.54 -43.61 98.38 Favored 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 162.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.519 0.1 OUTLIER 75.79 74.85 0.09 Allowed 'General case' 0 CA--C 1.571 1.759 0 C-N-CA 125.656 1.583 . . . . 0.0 112.578 -163.588 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -141.43 109.59 5.85 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.017 -1.052 . . . . 0.0 111.263 -176.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p -82.23 126.25 31.88 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.541 -0.725 . . . . 0.0 112.822 166.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' GLN . . . . . 0.402 ' HG3' ' H ' ' B' ' 30' ' ' GLU . 13.9 pt20 -146.32 170.14 17.39 Favored 'General case' 0 CA--C 1.565 1.524 0 CA-C-O 123.76 1.743 . . . . 0.0 114.913 -178.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.31 1.9 p-90 -115.96 43.23 2.17 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 166.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . 0.402 ' H ' ' HG3' ' B' ' 28' ' ' GLN . 0.0 OUTLIER -139.42 159.74 41.46 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 123.125 1.44 . . . . 0.0 110.516 162.659 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -90.48 142.71 28.38 Favored Pre-proline 0 CA--C 1.58 2.125 0 CA-C-N 114.829 -1.078 . . . . 0.0 112.469 166.387 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -60.15 -2.0 1.56 Allowed 'Trans proline' 0 CA--C 1.582 2.906 0 C-N-CA 123.589 2.859 . . . . 0.0 119.141 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.317 7.1 t . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -177.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.0 t . . . . . 0 N--CA 1.505 2.325 0 CA-C-O 121.961 0.886 . . . . 0.0 112.64 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.573 1.836 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -166.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.336 30.6 Cg_endo . . . . . 0 CA--C 1.586 3.087 0 N-CA-C 118.702 2.539 . . . . 0.0 118.702 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -66.52 142.32 64.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 CA-C-N 126.854 3.484 . . . . 0.0 115.149 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? . . . . . 0 N--CA 1.49 1.568 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -157.461 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 tptp . . . . . 0 N--CA 1.495 1.82 0 N-CA-C 111.025 0.009 . . . . 0.0 111.025 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.7 174.55 2.55 Favored Pre-proline 0 CA--C 1.589 2.452 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 165.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -72.92 157.08 51.95 Favored 'Trans proline' 0 CA--C 1.589 3.238 0 N-CA-C 121.782 3.724 . . . . 0.0 121.782 -174.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -72.21 135.01 24.04 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 C-N-CA 123.278 2.652 . . . . 0.0 113.123 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.7 27.77 45.45 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 118.821 2.289 . . . . 0.0 118.821 -165.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.28 23.1 m95 -111.3 162.53 14.91 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 120.004 1.902 . . . . 0.0 114.083 170.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.71 -155.15 0.59 Allowed 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 122.193 0.997 . . . . 0.0 112.505 149.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.33 120.37 10.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.913 -1.117 . . . . 0.0 111.567 -159.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.1 mtt-85 -136.66 115.74 12.43 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.24 -1.537 . . . . 0.0 113.338 -160.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.7 mtp -108.89 107.05 17.29 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -158.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' SER . . . . . 0.559 ' H ' ' HB ' ' B' ' 17' ' ' VAL 0.285 5.8 p 65.93 -163.1 0.25 Allowed 'General case' 0 CA--C 1.579 2.076 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 164.262 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -124.87 -75.18 0.6 Allowed 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.4 p -139.63 85.95 2.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 144.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 21.0 m -155.7 -27.69 0.1 Allowed 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 -158.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.19 44.32 7.61 Favored Glycine 0 N--CA 1.499 2.847 0 CA-C-N 121.213 1.824 . . . . 0.0 115.638 -170.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -137.57 172.5 12.87 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.494 1.118 . . . . 0.0 111.157 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.559 ' HB ' ' H ' ' B' ' 11' ' ' SER 0.535 2.2 t 71.82 141.44 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.58 2.122 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 160.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.279 3.0 p90 -170.39 10.48 0.02 OUTLIER 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 -171.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -148.86 145.52 27.52 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 123.183 2.719 . . . . 0.0 113.602 -176.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -151.7 127.2 10.05 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.899 -1.126 . . . . 0.0 111.135 177.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.6 126.66 40.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.216 -1.552 . . . . 0.0 111.003 170.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -79.14 -45.79 19.28 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mt -66.81 -51.78 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 124.302 1.041 . . . . 0.0 112.96 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 85.7 m -56.65 -46.13 81.22 Favored 'General case' 0 CA--C 1.577 2.018 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 163.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.523 0.0 OUTLIER 76.21 65.98 0.06 Allowed 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 125.462 1.505 . . . . 0.0 112.302 -163.72 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -125.09 122.7 37.95 Favored 'General case' 0 CA--C 1.557 1.222 0 O-C-N 121.185 -0.947 . . . . 0.0 110.418 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -99.69 121.43 41.22 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.973 -0.455 . . . . 0.0 110.937 167.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -153.51 171.1 19.24 Favored 'General case' 0 CA--C 1.562 1.407 0 CA-C-O 123.364 1.554 . . . . 0.0 113.21 -164.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.314 0.6 OUTLIER -127.11 51.1 1.91 Allowed 'General case' 0 CA--C 1.567 1.601 0 O-C-N 121.12 -0.988 . . . . 0.0 113.251 166.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -135.93 140.15 43.8 Favored 'General case' 0 CA--C 1.56 1.353 0 CA-C-O 122.238 1.018 . . . . 0.0 110.593 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 52.8 ttp85 -81.26 128.12 71.51 Favored Pre-proline 0 CA--C 1.576 1.961 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.83 171.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -61.25 6.5 0.14 Allowed 'Trans proline' 0 CA--C 1.581 2.843 0 N-CA-C 120.03 3.05 . . . . 0.0 120.03 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.384 37.7 p . . . . . 0 N--CA 1.498 1.973 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -175.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.8 t . . . . . 0 N--CA 1.498 1.944 0 CA-C-O 122.036 0.922 . . . . 0.0 109.004 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 16.2 mtp-105 . . . . . 0 CA--C 1.568 1.636 0 CA-C-O 122.322 1.058 . . . . 0.0 113.782 -171.159 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.277 24.3 Cg_endo . . . . . 0 CA--C 1.575 2.566 0 N-CA-C 117.265 1.987 . . . . 0.0 117.265 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.83 -103.26 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.666 0 CA-C-N 125.086 2.852 . . . . 0.0 112.267 162.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? . . . . . 0 CA--C 1.577 1.994 0 CA-C-N 119.613 1.097 . . . . 0.0 112.014 167.417 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 10.5 pttp . . . . . 0 CA--C 1.576 1.956 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.3 171.07 10.52 Favored Pre-proline 0 CA--C 1.589 2.469 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 163.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -73.31 154.83 51.41 Favored 'Trans proline' 0 CA--C 1.59 3.306 0 N-CA-C 122.118 3.853 . . . . 0.0 122.118 -172.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -71.62 129.41 15.61 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.96 2.44 . . . . 0.0 113.009 173.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.64 7.84 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 117.322 1.689 . . . . 0.0 117.322 -160.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -123.4 169.87 10.92 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-N 120.362 2.081 . . . . 0.0 116.477 171.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.07 178.81 8.39 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-O 124.12 1.914 . . . . 0.0 111.836 144.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.271 0.2 OUTLIER -100.42 127.08 46.84 Favored 'General case' 0 CA--C 1.573 1.828 0 CA-C-N 114.135 -1.393 . . . . 0.0 112.406 169.188 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -129.61 126.19 37.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.228 -1.545 . . . . 0.0 109.699 -170.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 86.3 mmm -112.77 136.0 52.88 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -156.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' SER . . . . . 0.432 ' H ' ' HB ' ' B' ' 17' ' ' VAL 0.261 24.3 p 47.86 61.17 3.1 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 121.342 3.83 . . . . 0.0 121.342 137.5 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -71.31 -15.48 62.41 Favored 'General case' 0 CA--C 1.582 2.18 0 N-CA-C 117.325 2.343 . . . . 0.0 117.325 165.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -131.15 174.66 9.81 Favored 'General case' 0 CA--C 1.578 2.036 0 O-C-N 120.871 -1.143 . . . . 0.0 110.433 155.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 14.7 t -68.75 96.3 0.73 Allowed 'General case' 0 CA--C 1.57 1.729 0 N-CA-C 115.61 1.708 . . . . 0.0 115.61 -164.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.02 55.08 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 115.49 0.956 . . . . 0.0 115.49 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -141.19 163.73 32.18 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.12 0.968 . . . . 0.0 110.398 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.432 ' HB ' ' H ' ' B' ' 11' ' ' SER 0.483 1.6 t 66.23 132.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.579 2.089 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 162.345 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.337 6.5 p90 -165.8 2.57 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.82 0 O-C-N 119.717 -1.864 . . . . 0.0 116.016 -171.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -144.01 156.77 44.52 Favored 'General case' 0 N--CA 1.502 2.148 0 CA-C-N 122.793 2.542 . . . . 0.0 114.142 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -161.75 129.75 4.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.294 -1.504 . . . . 0.0 109.441 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -83.65 125.61 32.03 Favored 'General case' 0 CA--C 1.576 1.943 0 O-C-N 120.106 -1.621 . . . . 0.0 110.645 168.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.75 -45.36 15.76 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 25.4 pt -67.12 -33.5 63.52 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 69.9 p -74.43 -49.59 21.84 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 114.773 1.398 . . . . 0.0 114.773 158.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.329 0.8 OUTLIER 82.6 58.83 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.996 0 C-N-CA 125.93 1.692 . . . . 0.0 112.592 -163.791 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -117.91 123.69 46.43 Favored 'General case' 0 CA--C 1.563 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 111.265 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 28.0 m -88.91 134.03 34.1 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.311 -0.868 . . . . 0.0 112.646 175.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -147.61 172.05 14.63 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 123.73 1.728 . . . . 0.0 113.424 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -121.92 60.62 0.97 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.314 -1.491 . . . . 0.0 110.358 163.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -156.77 130.18 8.07 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-O 121.977 0.894 . . . . 0.0 111.28 -152.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 -93.77 132.78 29.08 Favored Pre-proline 0 CA--C 1.573 1.852 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.168 -175.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -64.76 11.11 0.12 Allowed 'Trans proline' 0 CA--C 1.58 2.782 0 N-CA-C 119.499 2.846 . . . . 0.0 119.499 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.32 9.7 t . . . . . 0 N--CA 1.496 1.872 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 179.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.435 HG11 ' HD2' ' B' ' 9' ' ' ARG 0.258 13.6 t . . . . . 0 N--CA 1.503 2.208 0 CA-C-O 121.436 0.636 . . . . 0.0 110.063 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 122.128 0.966 . . . . 0.0 112.607 -172.511 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo . . . . . 0 CA--C 1.575 2.555 0 N-CA-C 118.804 2.579 . . . . 0.0 118.804 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.03 -63.68 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.282 0 CA-C-N 125.886 3.138 . . . . 0.0 115.532 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? . . . . . 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.046 . . . . 0.0 112.127 174.776 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 117.056 -1.45 . . . . 0.0 111.652 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.324 1.2 pp 47.82 175.76 0.01 OUTLIER Pre-proline 0 N--CA 1.51 2.559 0 N-CA-C 120.16 3.392 . . . . 0.0 120.16 175.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -78.94 158.05 27.3 Favored 'Trans proline' 0 CA--C 1.587 3.15 0 N-CA-C 122.126 3.856 . . . . 0.0 122.126 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.74 127.02 8.48 Favored 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 123.271 2.648 . . . . 0.0 113.133 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.21 23.82 16.14 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 118.095 1.998 . . . . 0.0 118.095 -163.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.283 22.1 m95 -119.52 169.28 10.19 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 120.87 2.335 . . . . 0.0 115.848 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -134.71 164.88 26.54 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 124.957 2.313 . . . . 0.0 113.731 151.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.33 123.89 30.08 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-N 112.783 -2.008 . . . . 0.0 110.177 142.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . 0.611 ' O ' HG13 ' B' ' 17' ' ' VAL . 2.7 mtt-85 -122.77 102.38 8.0 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 121.684 2.038 . . . . 0.0 110.599 -173.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.43 115.18 29.7 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -155.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 26.5 p 67.7 131.29 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.611 2.449 . . . . 0.0 117.611 168.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.61 -68.92 0.56 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.587 -1.321 . . . . 0.0 107.643 160.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 88.8 p -93.88 111.16 22.82 Favored 'General case' 0 CA--C 1.572 1.815 0 O-C-N 120.819 -1.175 . . . . 0.0 112.706 166.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . 0.278 38.8 p 63.88 40.27 7.57 Favored 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 119.885 3.291 . . . . 0.0 119.885 169.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.73 33.11 38.86 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 117.244 1.658 . . . . 0.0 117.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.408 ' O ' HG12 ' B' ' 17' ' ' VAL . 9.4 mpt_? -116.96 126.08 52.39 Favored 'General case' 0 CA--C 1.565 1.552 0 CA-C-N 118.487 1.143 . . . . 0.0 111.236 -171.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.611 HG13 ' O ' ' B' ' 9' ' ' ARG 0.846 0.7 OUTLIER 110.4 148.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.417 1.887 . . . . 0.0 114.565 -179.131 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.394 10.2 p90 -170.46 12.23 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.252 0 C-N-CA 126.272 1.829 . . . . 0.0 115.383 176.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -148.47 137.67 21.84 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 122.364 2.347 . . . . 0.0 111.986 165.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -143.02 135.45 27.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.637 -1.914 . . . . 0.0 110.844 173.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.22 120.55 31.47 Favored 'General case' 0 CA--C 1.57 1.739 0 O-C-N 120.203 -1.561 . . . . 0.0 110.536 169.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -76.7 -43.97 35.47 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 26.5 pt -71.64 -35.98 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 80.4 p -71.36 -50.76 29.0 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 159.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.317 34.7 t-20 83.72 64.74 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 126.115 1.766 . . . . 0.0 112.162 -163.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -128.49 118.75 23.6 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 123.514 0.726 . . . . 0.0 111.455 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 89.6 p -86.42 128.23 34.92 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -0.964 . . . . 0.0 113.301 171.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -137.72 177.8 7.59 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.031 1.396 . . . . 0.0 111.887 175.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.366 0.1 OUTLIER -128.74 47.09 2.5 Favored 'General case' 0 CA--C 1.571 1.785 0 O-C-N 119.794 -1.816 . . . . 0.0 114.097 164.092 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -147.56 160.38 42.7 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-O 125.329 2.49 . . . . 0.0 109.587 167.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.313 17.7 ttp-105 -64.53 155.87 79.56 Favored Pre-proline 0 CA--C 1.569 1.709 0 CA-C-N 112.842 -1.981 . . . . 0.0 116.239 171.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.21 65.7 1.46 Allowed 'Trans proline' 0 CA--C 1.573 2.429 0 C-N-CA 122.233 1.955 . . . . 0.0 112.258 154.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 CA--C 1.574 1.883 0 N-CA-C 119.841 3.275 . . . . 0.0 119.841 176.229 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.504 2.261 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? . . . . . 0 N--CA 1.504 2.266 0 N-CA-C 117.507 2.41 . . . . 0.0 117.507 -160.273 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo . . . . . 0 CA--C 1.578 2.698 0 N-CA-C 117.497 2.076 . . . . 0.0 117.497 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -72.86 92.5 0.79 Allowed 'Trans proline' 0 CA--C 1.566 2.082 0 CA-C-N 125.566 3.023 . . . . 0.0 111.589 171.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.571 1.759 0 CA-C-N 113.519 -1.673 . . . . 0.0 114.664 -165.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? . . . . . 0 CA--C 1.572 1.814 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.87 169.17 10.23 Favored Pre-proline 0 CA--C 1.588 2.42 0 N-CA-C 116.363 1.986 . . . . 0.0 116.363 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -70.88 153.61 63.7 Favored 'Trans proline' 0 CA--C 1.588 3.191 0 N-CA-C 122.157 3.868 . . . . 0.0 122.157 -172.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.21 126.74 10.68 Favored 'Trans proline' 0 CA--C 1.566 2.096 0 C-N-CA 123.183 2.589 . . . . 0.0 112.664 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.89 28.36 10.17 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 -161.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.254 12.6 m95 -114.54 162.96 16.04 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.276 2.038 . . . . 0.0 114.072 171.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -153.92 141.38 19.74 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-O 123.285 1.517 . . . . 0.0 114.916 152.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.44 128.17 35.82 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 166.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -129.59 106.88 9.04 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-N 120.494 1.497 . . . . 0.0 111.441 -174.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 3.2 ttm -114.82 129.3 56.67 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -132.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.344 24.5 p 78.42 157.85 0.17 Allowed 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 154.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -151.42 -50.55 0.12 Allowed 'General case' 0 CA--C 1.57 1.748 0 C-N-CA 124.524 1.13 . . . . 0.0 112.318 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 93.2 p -100.16 -61.89 1.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.0 112.786 157.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 97.3 p -119.15 -59.49 1.84 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -163.52 45.28 0.32 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 116.863 1.505 . . . . 0.0 116.863 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.12 144.32 44.3 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.548 1.139 . . . . 0.0 113.303 169.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.731 0.5 OUTLIER 73.45 124.84 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 CA-C-N 115.274 -0.875 . . . . 0.0 112.416 -142.68 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.308 9.8 p90 -172.29 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.16 0 CA-C-O 116.08 -1.914 . . . . 0.0 114.841 -174.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -153.85 148.79 26.66 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 124.357 3.253 . . . . 0.0 115.591 174.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -161.48 136.55 7.44 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 125.903 1.681 . . . . 0.0 109.123 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.12 128.47 44.07 Favored 'General case' 0 CA--C 1.571 1.752 0 O-C-N 120.27 -1.519 . . . . 0.0 110.642 172.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -75.16 -55.83 5.33 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.162 -1.586 . . . . 0.0 114.163 174.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -60.64 -35.16 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.36 -17.42 23.57 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 164.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.326 3.0 t-20 64.59 24.44 13.02 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 -164.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.54 150.73 43.27 Favored 'General case' 0 CA--C 1.573 1.863 0 O-C-N 119.599 -1.938 . . . . 0.0 114.273 164.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.4 m -152.56 122.09 6.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.964 -1.71 . . . . 0.0 111.2 -170.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -162.55 177.08 9.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 124.051 1.882 . . . . 0.0 112.952 -150.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.273 0.1 OUTLIER -119.01 39.44 3.54 Favored 'General case' 0 CA--C 1.577 1.995 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.824 155.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -127.13 134.14 50.25 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 122.394 1.093 . . . . 0.0 110.396 -167.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -90.56 123.97 63.84 Favored Pre-proline 0 CA--C 1.574 1.903 0 CA-C-O 117.897 -1.049 . . . . 0.0 113.512 -172.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -60.02 -39.83 66.89 Favored 'Trans proline' 0 CA--C 1.569 2.261 0 N-CA-C 117.845 2.21 . . . . 0.0 117.845 171.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.34 1.2 m . . . . . 0 N--CA 1.499 2.011 0 C-N-CA 125.134 1.374 . . . . 0.0 114.606 -165.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.333 2.4 t . . . . . 0 N--CA 1.503 2.207 0 CA-C-O 121.262 0.553 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.264 24.2 ptt-85 . . . . . 0 N--CA 1.501 2.113 0 O-C-N 119.878 -1.763 . . . . 0.0 115.759 -156.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.293 18.1 Cg_endo . . . . . 0 CA--C 1.582 2.912 0 N-CA-C 119.548 2.865 . . . . 0.0 119.548 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -70.37 -49.31 0.48 Allowed 'Trans proline' 0 CA--C 1.567 2.127 0 CA-C-N 126.187 3.245 . . . . 0.0 117.487 -174.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.801 0 O-C-N 120.912 -1.118 . . . . 0.0 111.912 165.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 20.4 tptm . . . . . 0 CA--C 1.577 2.006 0 CA-C-O 120.941 0.401 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -144.59 176.28 2.33 Favored Pre-proline 0 CA--C 1.587 2.38 0 C-N-CA 124.471 1.109 . . . . 0.0 109.485 164.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -76.13 157.32 38.07 Favored 'Trans proline' 0 CA--C 1.584 3.016 0 N-CA-C 121.21 3.504 . . . . 0.0 121.21 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -79.19 124.33 5.95 Favored 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.117 2.545 . . . . 0.0 112.879 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.39 30.7 9.62 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 117.944 1.937 . . . . 0.0 117.944 -164.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . 0.504 ' CZ2' ' HG3' ' B' ' 32' ' ' PRO 0.268 22.4 m95 -114.13 162.82 16.02 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.506 1.653 . . . . 0.0 114.102 170.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -147.75 -148.62 0.26 Allowed 'General case' 0 CA--C 1.573 1.83 0 CA-C-O 121.93 0.871 . . . . 0.0 112.468 149.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.77 118.24 9.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.76 -1.212 . . . . 0.0 111.157 -161.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 mtt-85 -140.75 121.72 14.58 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.184 -1.573 . . . . 0.0 112.075 -161.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.5 mtp -113.18 142.33 45.9 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 118.355 2.724 . . . . 0.0 118.355 -150.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.301 46.7 m 65.57 62.11 0.67 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 118.495 2.776 . . . . 0.0 118.495 155.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' ARG . . . . . 0.463 ' H ' HG12 ' B' ' 17' ' ' VAL . 16.0 mtp180 -65.75 -29.26 69.75 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 156.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 74.9 m -133.63 136.78 45.04 Favored 'General case' 0 CA--C 1.563 1.469 0 O-C-N 120.477 -1.39 . . . . 0.0 108.588 156.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 49.9 m -35.23 102.26 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 119.068 2.988 . . . . 0.0 119.068 -165.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 99.18 -0.4 57.27 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 119.047 2.379 . . . . 0.0 119.047 -173.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? -127.59 128.15 45.08 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 120.484 2.142 . . . . 0.0 112.371 -166.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.463 HG12 ' H ' ' B' ' 12' ' ' ARG 0.82 0.3 OUTLIER 99.46 135.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 C-N-CA 125.892 1.677 . . . . 0.0 112.217 -160.199 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.3 2.5 p90 -173.74 9.49 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.325 0 C-N-CA 126.184 1.794 . . . . 0.0 115.712 -170.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -147.27 144.92 29.19 Favored 'General case' 0 N--CA 1.511 2.603 0 CA-C-N 122.673 2.488 . . . . 0.0 112.982 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -152.89 129.79 10.98 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.137 -1.602 . . . . 0.0 112.666 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.71 125.04 37.15 Favored 'General case' 0 CA--C 1.573 1.831 0 O-C-N 120.197 -1.564 . . . . 0.0 111.063 168.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 -68.6 -42.5 78.07 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 9.0 mt -71.4 -54.84 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.166 0.986 . . . . 0.0 112.763 -171.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' THR . . . . . 0.589 HG23 ' H ' ' B' ' 26' ' ' ALA . 9.1 t -81.33 -15.98 53.74 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 171.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.285 6.4 t-20 61.9 17.47 8.94 Favored 'General case' 0 CA--C 1.582 2.193 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 -160.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' ALA . . . . . 0.589 ' H ' HG23 ' B' ' 24' ' ' THR . . . -58.9 96.85 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 O-C-N 119.874 -1.766 . . . . 0.0 113.29 162.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 9.3 m -113.59 122.75 48.15 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -170.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.86 163.69 38.91 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 124.154 1.931 . . . . 0.0 115.074 -154.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -102.42 49.12 0.85 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 113.846 -1.524 . . . . 0.0 112.378 168.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -161.04 138.77 9.33 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 123.092 1.425 . . . . 0.0 111.045 -148.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 68.8 ttt-85 -107.33 112.54 62.67 Favored Pre-proline 0 CA--C 1.573 1.839 0 CA-C-O 117.772 -1.109 . . . . 0.0 112.884 -155.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . 0.504 ' HG3' ' CZ2' ' B' ' 6' ' ' TRP . 39.2 Cg_endo -68.36 -48.5 1.17 Allowed 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 122.408 2.072 . . . . 0.0 115.335 174.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.498 1.951 0 N-CA-C 118.828 2.899 . . . . 0.0 118.828 177.353 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.6 t . . . . . 0 N--CA 1.505 2.305 0 CA-C-O 123.937 1.827 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.574 1.888 0 CA-C-N 113.435 -1.711 . . . . 0.0 115.099 -172.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.253 6.3 Cg_exo . . . . . 0 CA--C 1.573 2.442 0 N-CA-C 118.524 2.471 . . . . 0.0 118.524 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -80.25 -111.61 0.01 OUTLIER 'Trans proline' 0 CA--C 1.572 2.397 0 CA-C-N 125.343 2.944 . . . . 0.0 112.507 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.568 1.648 0 O-C-N 120.317 -1.489 . . . . 0.0 110.388 172.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? . . . . . 0 CA--C 1.57 1.736 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -63.08 170.82 2.35 Favored Pre-proline 0 CA--C 1.586 2.364 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . 0.25 33.6 Cg_exo -68.1 155.6 68.93 Favored 'Trans proline' 0 CA--C 1.593 3.44 0 N-CA-C 122.45 3.981 . . . . 0.0 122.45 -172.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -73.41 135.73 22.79 Favored 'Trans proline' 0 CA--C 1.563 1.975 0 C-N-CA 123.311 2.674 . . . . 0.0 112.694 175.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.06 32.15 26.91 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 -161.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.261 17.1 m95 -116.68 162.44 17.65 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 120.589 2.195 . . . . 0.0 114.521 170.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.95 -148.1 0.24 Allowed 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.966 0.889 . . . . 0.0 111.671 150.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -149.49 118.93 6.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.227 -1.546 . . . . 0.0 110.415 -163.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -137.93 115.48 11.26 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.098 -1.626 . . . . 0.0 114.449 -161.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' MET . . . . . 0.407 ' HA ' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -101.11 114.04 27.62 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -152.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 78.9 p 46.7 87.33 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 119.998 3.332 . . . . 0.0 119.998 169.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' ARG . . . . . . . . . . . . 0.256 0.0 OUTLIER -56.03 -40.49 73.53 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 173.005 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 84.9 p -160.6 55.49 0.32 Allowed 'General case' 0 CA--C 1.576 1.974 0 C-N-CA 124.283 1.033 . . . . 0.0 111.584 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -164.82 -114.34 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.399 -1.438 . . . . 0.0 109.809 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -161.33 26.69 0.27 Allowed Glycine 0 N--CA 1.498 2.816 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 172.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -138.47 170.7 15.56 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 125.019 1.327 . . . . 0.0 109.408 171.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 10' ' ' MET 0.809 0.3 OUTLIER 93.31 131.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 120.774 -1.204 . . . . 0.0 111.723 -156.543 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.339 1.4 p90 -177.83 8.73 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.477 0 C-N-CA 126.084 1.754 . . . . 0.0 114.606 -167.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -136.12 137.44 41.01 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 119.185 -2.197 . . . . 0.0 109.373 174.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -140.12 130.28 25.04 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 119.509 -1.994 . . . . 0.0 112.922 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.63 129.7 39.81 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.091 -1.631 . . . . 0.0 111.149 171.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -82.69 -53.56 5.82 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 175.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 31.1 pt -62.94 -50.0 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 94.5 m -58.17 -42.3 85.71 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 158.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.314 11.5 t-20 77.5 73.02 0.06 Allowed 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 125.763 1.625 . . . . 0.0 109.433 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -152.0 134.56 15.38 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.535 -0.728 . . . . 0.0 111.811 -169.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 92.5 p -86.62 131.7 34.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.023 -1.048 . . . . 0.0 112.555 161.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.274 1.3 pt20 -133.68 161.72 33.89 Favored 'General case' 0 CA--C 1.566 1.571 0 CA-C-O 122.573 1.177 . . . . 0.0 112.682 167.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.276 0.1 OUTLIER -108.87 19.61 19.42 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 170.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -157.56 38.89 0.28 Allowed 'General case' 0 CA--C 1.567 1.607 0 N-CA-C 119.869 3.285 . . . . 0.0 119.869 -171.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 54.28 142.67 0.03 OUTLIER Pre-proline 0 CA--C 1.59 2.493 0 N-CA-C 121.393 3.849 . . . . 0.0 121.393 166.379 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -69.45 3.24 2.74 Favored 'Trans proline' 0 CA--C 1.578 2.684 0 N-CA-C 118.36 2.408 . . . . 0.0 118.36 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.358 8.6 m . . . . . 0 N--CA 1.501 2.083 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 -172.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 119.028 -0.511 . . . . 0.0 110.775 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 8.7 p -71.94 144.04 13.59 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.135 0 CA-C-N 119.242 0.928 . . . . 0.0 112.236 168.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.2 t -148.93 141.18 24.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.868 -1.145 . . . . 0.0 113.51 -175.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.8 p -72.7 155.2 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.091 0 O-C-N 121.63 -0.669 . . . . 0.0 111.59 150.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 41.0 t -76.99 123.33 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 CA-C-O 121.971 0.891 . . . . 0.0 109.081 174.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.75 99.11 9.32 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 122.598 1.19 . . . . 0.0 113.555 -172.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.294 9.7 Cg_endo -53.3 -53.64 6.32 Favored 'Trans proline' 0 CA--C 1.578 2.694 0 CA-C-N 123.929 2.439 . . . . 0.0 117.89 -173.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_endo -83.06 -117.62 0.01 OUTLIER 'Trans proline' 0 CA--C 1.582 2.915 0 CA-C-N 123.987 2.46 . . . . 0.0 111.885 162.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -147.55 178.11 8.71 Favored 'General case' 0 CA--C 1.576 1.95 0 O-C-N 120.202 -1.561 . . . . 0.0 111.244 164.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 22.7 t -65.21 138.25 97.17 Favored Pre-proline 0 CA--C 1.584 2.268 0 O-C-N 120.54 -1.35 . . . . 0.0 113.736 164.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -78.19 49.56 3.04 Favored 'Trans proline' 0 CA--C 1.577 2.65 0 N-CA-C 118.467 2.449 . . . . 0.0 118.467 -176.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 11.5 t . . . . . 0 C--O 1.254 1.298 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 152.314 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . 0.264 0.0 OUTLIER . . . . . 0 CA--C 1.581 2.162 0 N-CA-C 113.296 0.851 . . . . 0.0 113.296 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.0 pp -74.71 171.66 10.94 Favored Pre-proline 0 CA--C 1.589 2.477 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_exo -72.79 156.27 53.11 Favored 'Trans proline' 0 CA--C 1.586 3.107 0 N-CA-C 121.958 3.792 . . . . 0.0 121.958 -174.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.28 129.26 15.72 Favored 'Trans proline' 0 CA--C 1.565 2.06 0 C-N-CA 123.029 2.486 . . . . 0.0 113.605 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 86.95 28.82 24.87 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 118.578 2.191 . . . . 0.0 118.578 -167.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.251 16.5 m95 -109.76 177.09 4.83 Favored 'General case' 0 CA--C 1.56 1.358 0 CA-C-N 120.241 2.021 . . . . 0.0 116.352 173.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -148.56 162.36 39.81 Favored 'General case' 0 CA--C 1.568 1.644 0 CA-C-O 124.122 1.915 . . . . 0.0 111.081 147.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.254 0.1 OUTLIER -101.14 116.75 33.54 Favored 'General case' 0 CA--C 1.57 1.72 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.541 171.839 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 mmt180 -101.05 160.23 14.55 Favored 'General case' 0 CA--C 1.557 1.224 0 O-C-N 120.093 -1.63 . . . . 0.0 107.98 -177.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.18 125.04 13.43 Favored 'General case' 0 N--CA 1.484 1.23 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -173.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.292 20.7 p 74.99 146.63 0.09 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 119.047 2.98 . . . . 0.0 119.047 157.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 39.8 mtm-85 -130.0 -68.64 0.7 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.91 -1.119 . . . . 0.0 110.11 162.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 96.2 p -115.68 -70.65 0.78 Allowed 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 119.194 0.907 . . . . 0.0 111.941 170.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 34.0 t -72.18 1.98 6.66 Favored 'General case' 0 CA--C 1.579 2.096 0 N-CA-C 119.227 3.047 . . . . 0.0 119.227 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.66 54.61 1.91 Allowed Glycine 0 N--CA 1.489 2.169 0 CA-C-N 120.704 1.593 . . . . 0.0 113.628 -177.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -136.29 137.77 41.05 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 123.207 1.479 . . . . 0.0 113.676 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.434 HG22 ' H ' ' B' ' 18' ' ' TYR 0.802 1.1 p 135.1 148.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.126 0 C-N-CA 129.239 3.016 . . . . 0.0 111.642 177.723 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.434 ' H ' HG22 ' B' ' 17' ' ' VAL 0.345 52.4 m-85 -135.95 -48.2 0.67 Allowed 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.305 2.335 . . . . 0.0 117.305 -159.05 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -155.38 146.82 22.91 Favored 'General case' 0 N--CA 1.499 1.998 0 CA-C-O 123.11 1.433 . . . . 0.0 113.615 -160.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -151.42 122.53 7.69 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.512 -1.367 . . . . 0.0 108.55 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -77.35 124.24 27.6 Favored 'General case' 0 CA--C 1.57 1.744 0 O-C-N 119.736 -1.852 . . . . 0.0 110.833 174.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.33 -46.82 11.37 Favored 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 115.862 1.801 . . . . 0.0 115.862 -175.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.5 pt -61.82 -45.09 99.45 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.281 0 N-CA-C 115.414 1.635 . . . . 0.0 115.414 172.595 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 55.3 m -66.58 -48.11 70.63 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 165.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.343 53.4 m-80 77.97 68.41 0.04 OUTLIER 'General case' 0 CA--C 1.569 1.673 0 C-N-CA 126.499 1.92 . . . . 0.0 112.656 -166.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -137.71 124.5 21.16 Favored 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 123.777 0.831 . . . . 0.0 110.739 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 37.4 m -83.39 142.26 31.14 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.377 -0.827 . . . . 0.0 112.892 172.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.27 10.1 pt20 -148.17 173.42 12.99 Favored 'General case' 0 CA--C 1.562 1.426 0 CA-C-O 123.58 1.657 . . . . 0.0 113.305 166.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.305 0.1 OUTLIER -111.33 39.69 2.25 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 114.839 1.422 . . . . 0.0 114.839 169.297 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -155.11 160.1 40.71 Favored 'General case' 0 CA--C 1.563 1.472 0 CA-C-O 123.728 1.727 . . . . 0.0 111.228 174.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.25 15.2 ttt85 -54.2 157.49 4.56 Favored Pre-proline 0 CA--C 1.585 2.314 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 159.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -60.52 17.9 0.04 OUTLIER 'Trans proline' 0 CA--C 1.584 3.02 0 N-CA-C 119.173 2.72 . . . . 0.0 119.173 164.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.322 8.4 t 67.58 -76.69 0.05 Allowed 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 125.538 1.535 . . . . 0.0 114.253 -172.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 50.77 51.88 32.02 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 120.715 3.046 . . . . 0.0 120.715 172.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -142.12 101.27 3.89 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-N 117.821 0.81 . . . . 0.0 109.585 -177.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 18.0 m -69.98 155.25 40.85 Favored 'General case' 0 CA--C 1.57 1.719 0 N-CA-C 116.02 1.859 . . . . 0.0 116.02 -177.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 58.4 m -148.6 -59.49 0.23 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.094 -1.004 . . . . 0.0 112.622 174.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 77.9 p -125.57 72.15 1.25 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.212 -0.93 . . . . 0.0 109.767 165.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.075 0 CA-C-O 118.89 -0.95 . . . . 0.0 110.982 -145.442 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.7 tptm . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 119.274 -0.393 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.9 t -79.0 142.14 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 CA-C-N 118.702 0.683 . . . . 0.0 110.206 168.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.7 t -142.78 112.24 6.74 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.28 -0.887 . . . . 0.0 110.567 175.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 72.3 t -78.21 102.86 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.057 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 177.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.302 3.4 t 76.94 112.42 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.199 0 C-N-CA 124.439 1.096 . . . . 0.0 109.797 -168.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 35.0 ttp85 -143.59 148.16 35.46 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 120.969 -1.082 . . . . 0.0 113.471 -168.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.282 13.4 Cg_endo -57.96 -61.12 0.3 Allowed 'Trans proline' 0 CA--C 1.585 3.052 0 C-N-CA 122.68 2.254 . . . . 0.0 116.805 169.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -80.06 -111.37 0.01 OUTLIER 'Trans proline' 0 CA--C 1.578 2.704 0 CA-C-N 125.018 2.828 . . . . 0.0 112.942 173.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.0 pttt -157.51 159.95 37.73 Favored 'General case' 0 CA--C 1.573 1.841 0 O-C-N 120.546 -1.347 . . . . 0.0 112.194 167.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.3 t -58.94 147.7 72.46 Favored Pre-proline 0 CA--C 1.586 2.338 0 CA-C-O 117.555 -1.212 . . . . 0.0 113.789 154.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.53 75.64 3.42 Favored 'Trans proline' 0 CA--C 1.573 2.439 0 CA-C-N 123.372 2.24 . . . . 0.0 117.414 -170.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 79.3 p . . . . . 0 N--CA 1.484 1.229 0 N-CA-C 106.778 -1.564 . . . . 0.0 106.778 171.118 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.584 2.255 0 N-CA-C 118.071 2.619 . . . . 0.0 118.071 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.372 0.6 OUTLIER 50.41 163.62 0.04 OUTLIER Pre-proline 0 CA--C 1.59 2.481 0 N-CA-C 118.205 2.668 . . . . 0.0 118.205 -157.313 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_exo -77.72 156.02 31.34 Favored 'Trans proline' 0 CA--C 1.591 3.366 0 N-CA-C 121.927 3.78 . . . . 0.0 121.927 -176.5 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -73.34 130.54 15.23 Favored 'Trans proline' 0 CA--C 1.565 2.065 0 C-N-CA 123.135 2.556 . . . . 0.0 112.648 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.72 25.74 17.04 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 118.017 1.967 . . . . 0.0 118.017 -161.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.276 26.5 m95 -117.61 171.46 8.01 Favored 'General case' 0 CA--C 1.561 1.398 0 CA-C-N 120.387 2.094 . . . . 0.0 115.856 172.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -157.55 137.18 12.16 Favored 'General case' 0 CA--C 1.568 1.637 0 CA-C-O 122.454 1.121 . . . . 0.0 113.187 147.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.67 127.53 32.76 Favored 'General case' 0 N--CA 1.498 1.933 0 N-CA-C 115.064 1.505 . . . . 0.0 115.064 174.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 14.8 mtt-85 -137.07 111.62 8.65 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 119.996 -1.69 . . . . 0.0 110.737 -167.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 28.7 mtp -114.6 141.76 47.34 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 116.906 2.188 . . . . 0.0 116.906 -138.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.266 54.3 p 60.68 64.99 1.09 Allowed 'General case' 0 N--CA 1.501 2.092 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 137.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 62.1 mtm180 -88.63 -12.18 43.25 Favored 'General case' 0 N--CA 1.501 2.107 0 N-CA-C 116.353 1.983 . . . . 0.0 116.353 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 68.9 m -144.64 -112.29 0.1 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 120.483 -1.386 . . . . 0.0 108.255 166.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 48.2 m -86.48 56.56 4.05 Favored 'General case' 0 N--CA 1.5 2.069 0 CA-C-N 121.45 1.932 . . . . 0.0 115.176 -175.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 75.5 53.3 6.07 Favored Glycine 0 N--CA 1.489 2.174 0 O-C-N 120.514 -1.366 . . . . 0.0 114.719 -177.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -132.8 144.47 50.26 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 122.259 1.028 . . . . 0.0 112.191 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.678 0.5 OUTLIER 73.27 135.76 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 N-CA-C 115.42 1.637 . . . . 0.0 115.42 -159.113 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.351 1.9 p90 -175.02 7.07 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.311 0 C-N-CA 126.281 1.833 . . . . 0.0 114.905 -169.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -146.49 148.11 31.89 Favored 'General case' 0 N--CA 1.505 2.319 0 CA-C-N 122.42 2.373 . . . . 0.0 112.76 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -150.58 123.37 8.64 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.112 -1.617 . . . . 0.0 108.199 173.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -85.28 126.1 33.43 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 119.959 -1.713 . . . . 0.0 110.641 172.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -88.17 -46.68 9.06 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 116.297 1.962 . . . . 0.0 116.297 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 33.5 pt -58.93 -40.26 79.91 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.382 0 N-CA-C 116.026 1.861 . . . . 0.0 116.026 172.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 56.4 m -71.55 -45.48 62.21 Favored 'General case' 0 CA--C 1.578 2.044 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 160.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.327 6.2 t30 79.04 67.91 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 C-N-CA 125.838 1.655 . . . . 0.0 112.366 -169.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -142.38 122.65 13.88 Favored 'General case' 0 CA--C 1.563 1.451 0 C-N-CA 123.391 0.676 . . . . 0.0 111.641 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 79.4 p -81.04 134.15 35.62 Favored 'General case' 0 N--CA 1.489 1.521 0 N-CA-C 113.797 1.036 . . . . 0.0 113.797 169.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 17.4 pt20 -153.4 167.6 28.87 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 116.199 1.926 . . . . 0.0 116.199 -179.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.259 0.2 OUTLIER -113.3 36.92 3.35 Favored 'General case' 0 CA--C 1.572 1.818 0 CA-C-N 113.622 -1.626 . . . . 0.0 114.986 169.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -148.14 157.4 43.48 Favored 'General case' 0 CA--C 1.571 1.767 0 CA-C-O 125.588 2.613 . . . . 0.0 111.408 167.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.341 18.7 ttp-105 -69.05 150.98 97.41 Favored Pre-proline 0 CA--C 1.58 2.13 0 CA-C-N 112.09 -2.323 . . . . 0.0 115.655 174.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -57.34 -35.92 98.89 Favored 'Trans proline' 0 CA--C 1.57 2.278 0 C-N-CA 122.614 2.209 . . . . 0.0 117.083 168.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.314 1.6 t 73.0 -41.1 0.49 Allowed 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 119.446 3.128 . . . . 0.0 119.446 165.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 74.86 25.55 69.18 Favored Glycine 0 N--CA 1.499 2.857 0 N-CA-C 120.015 2.766 . . . . 0.0 120.015 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 25.7 m120 -92.18 84.88 5.31 Favored 'General case' 0 CA--C 1.567 1.632 0 CA-C-N 119.045 1.422 . . . . 0.0 112.061 -171.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 23.1 t -136.82 -62.1 0.65 Allowed 'General case' 0 N--CA 1.494 1.736 0 C-N-CA 123.306 0.642 . . . . 0.0 112.517 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 7.3 m -75.89 110.19 10.14 Favored 'General case' 0 CA--C 1.565 1.524 0 CA-C-O 124.478 2.085 . . . . 0.0 113.816 175.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 31.6 t -99.96 64.85 1.25 Allowed 'General case' 0 CA--C 1.575 1.907 0 CA-C-N 112.148 -2.297 . . . . 0.0 110.486 138.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.935 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -150.608 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.575 1.932 0 CA-C-O 119.183 -0.437 . . . . 0.0 110.713 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 58.9 t -78.39 142.06 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.418 0 CA-C-N 119.924 1.238 . . . . 0.0 111.391 177.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.1 m -94.41 -65.82 0.96 Allowed 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.773 -1.204 . . . . 0.0 112.892 165.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.0 m -78.77 112.5 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 CA-C-N 119.764 1.166 . . . . 0.0 111.748 176.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.9 t -83.26 77.86 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.276 0 CA-C-O 125.401 2.524 . . . . 0.0 111.355 -169.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.11 149.51 47.52 Favored 'General case' 0 CA--C 1.575 1.926 0 CA-C-N 111.276 -2.693 . . . . 0.0 115.354 -172.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TPO . . . . . 1.173 ' O1P' ' O ' ' A' ' 13' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.31 36.9 Cg_endo -84.81 -85.76 0.0 OUTLIER 'Trans proline' 0 CA--C 1.586 3.094 0 C-N-CA 123.702 2.935 . . . . 0.0 114.952 177.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -77.48 81.17 2.72 Favored 'Trans proline' 0 CA--C 1.57 2.312 0 CA-C-N 127.969 3.882 . . . . 0.0 112.809 173.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.53 151.84 44.63 Favored 'General case' 0 CA--C 1.57 1.728 0 N-CA-C 120.482 3.512 . . . . 0.0 120.482 -144.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.7 166.54 0.3 Allowed Pre-proline 0 CA--C 1.578 2.046 0 N-CA-C 115.991 1.849 . . . . 0.0 115.991 150.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -52.19 -48.71 20.34 Favored 'Trans proline' 0 CA--C 1.574 2.5 0 CA-C-N 123.491 2.283 . . . . 0.0 115.833 166.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 1.173 ' O ' ' O1P' ' A' ' 7' ' ' TPO . 13.5 t . . . . . 0 CA--C 1.57 1.74 0 N-CA-C 112.783 0.661 . . . . 0.0 112.783 154.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 55.2 pttt . . . . . 0 CA--C 1.573 1.843 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.3 pp -115.35 175.59 1.84 Allowed Pre-proline 0 CA--C 1.588 2.409 0 CA-C-O 118.513 -0.756 . . . . 0.0 112.167 159.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -80.0 158.57 23.95 Favored 'Trans proline' 0 CA--C 1.59 3.299 0 N-CA-C 122.218 3.892 . . . . 0.0 122.218 -177.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -78.47 129.87 9.62 Favored 'Trans proline' 0 CA--C 1.564 2.017 0 C-N-CA 123.233 2.622 . . . . 0.0 112.735 -179.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.22 25.96 20.05 Favored Glycine 0 N--CA 1.491 2.356 0 N-CA-C 117.975 1.95 . . . . 0.0 117.975 -162.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.273 26.0 m95 -113.82 164.4 13.8 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-N 119.804 1.802 . . . . 0.0 114.662 172.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -145.17 -154.58 0.55 Allowed 'General case' 0 CA--C 1.569 1.708 0 CA-C-O 122.397 1.094 . . . . 0.0 112.219 147.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -145.28 119.61 9.59 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.816 -1.177 . . . . 0.0 111.293 -160.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 18.7 mtt-85 -139.76 115.38 10.05 Favored 'General case' 0 N--CA 1.502 2.168 0 O-C-N 120.263 -1.523 . . . . 0.0 111.486 -161.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 26.8 mtp -114.32 142.07 46.79 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 117.985 2.587 . . . . 0.0 117.985 -139.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.323 55.9 p 71.59 75.83 0.17 Allowed 'General case' 0 N--CA 1.498 1.945 0 N-CA-C 117.56 2.429 . . . . 0.0 117.56 151.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 24.8 mtp180 -102.48 -13.44 17.23 Favored 'General case' 0 CA--C 1.578 2.036 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 164.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 72.1 m -144.23 -157.03 0.75 Allowed 'General case' 0 CA--C 1.581 2.16 0 O-C-N 119.957 -1.715 . . . . 0.0 109.643 163.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 74.3 p -71.37 88.53 0.88 Allowed 'General case' 0 CA--C 1.576 1.945 0 O-C-N 119.328 -2.107 . . . . 0.0 115.105 -174.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 71.23 46.0 45.29 Favored Glycine 0 N--CA 1.495 2.585 0 N-CA-C 116.122 1.209 . . . . 0.0 116.122 -169.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 7.6 mpt_? -134.2 122.74 23.22 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 117.975 0.887 . . . . 0.0 110.414 -163.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.783 0.3 OUTLIER 85.84 129.87 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 C-N-CA 124.712 1.205 . . . . 0.0 112.892 -168.204 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -177.09 5.69 0.01 OUTLIER 'General case' 0 CA--C 1.576 1.976 0 C-N-CA 126.508 1.923 . . . . 0.0 115.607 -162.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -146.51 142.53 28.15 Favored 'General case' 0 N--CA 1.502 2.166 0 CA-C-N 123.303 2.774 . . . . 0.0 112.3 -174.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 87.2 t80 -147.47 127.82 13.96 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.324 1.049 . . . . 0.0 110.558 174.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -94.54 122.49 37.18 Favored 'General case' 0 CA--C 1.576 1.976 0 O-C-N 120.118 -1.614 . . . . 0.0 111.213 172.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -76.36 -53.25 8.45 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 114.99 1.478 . . . . 0.0 114.99 178.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -65.27 -45.9 92.23 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.108 0 N-CA-C 115.391 1.626 . . . . 0.0 115.391 179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 89.6 m -61.5 -45.17 95.35 Favored 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 164.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.288 13.3 t30 82.76 65.55 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 125.706 1.602 . . . . 0.0 112.269 -170.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -143.73 112.41 6.54 Favored 'General case' 0 N--CA 1.488 1.43 0 CA-C-O 121.601 0.715 . . . . 0.0 112.217 -173.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 76.1 p -80.88 134.88 35.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.99 -1.069 . . . . 0.0 113.591 163.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -161.56 157.97 25.61 Favored 'General case' 0 CA--C 1.564 1.5 0 CA-C-O 123.342 1.544 . . . . 0.0 113.867 -171.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.283 0.5 OUTLIER -101.01 42.54 1.11 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 114.748 -1.114 . . . . 0.0 113.528 160.112 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -132.18 139.5 48.4 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-O 122.472 1.13 . . . . 0.0 111.712 -170.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 19.7 ttp180 -90.04 130.28 42.98 Favored Pre-proline 0 CA--C 1.577 1.993 0 CA-C-O 118.021 -0.99 . . . . 0.0 113.164 175.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.19 -37.19 93.17 Favored 'Trans proline' 0 CA--C 1.574 2.506 0 C-N-CA 122.713 2.276 . . . . 0.0 116.532 172.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.9 t -82.54 -0.62 47.54 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 117.845 2.535 . . . . 0.0 117.845 167.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.11 62.64 0.54 Allowed Glycine 0 N--CA 1.502 3.055 0 O-C-N 119.805 -1.81 . . . . 0.0 115.342 155.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 60.1 t-20 -164.99 147.66 8.23 Favored 'General case' 0 CA--C 1.567 1.604 0 C-N-CA 123.422 0.689 . . . . 0.0 109.527 -153.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 66.1 m -61.3 -35.94 78.73 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 116.871 2.174 . . . . 0.0 116.871 165.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 82.8 p -85.41 110.08 18.89 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-N 119.999 1.272 . . . . 0.0 112.699 162.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -134.2 133.6 41.09 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 114.115 -1.402 . . . . 0.0 109.713 166.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.067 0 O-C-N 121.587 -0.696 . . . . 0.0 113.885 -177.499 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.7 pttm . . . . . 0 CA--C 1.57 1.729 0 CA-C-O 118.948 -0.549 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 92.1 t -83.55 155.55 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 CA-C-N 119.113 0.869 . . . . 0.0 110.355 171.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.0 p -73.66 77.95 1.52 Allowed 'General case' 0 CA--C 1.575 1.912 0 O-C-N 120.582 -1.324 . . . . 0.0 113.085 165.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.471 13.5 t 68.21 -115.47 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 C-N-CA 123.85 0.86 . . . . 0.0 110.755 -170.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.3 t -135.76 129.23 48.11 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.815 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 167.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -140.1 124.85 18.25 Favored 'General case' 0 CA--C 1.575 1.926 0 O-C-N 120.358 -1.463 . . . . 0.0 111.483 -159.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.382 18.1 Cg_endo -60.66 -81.4 0.01 OUTLIER 'Trans proline' 0 CA--C 1.585 3.05 0 C-N-CA 123.246 2.631 . . . . 0.0 118.523 -159.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.0 154.06 42.21 Favored 'Trans proline' 0 CA--C 1.569 2.264 0 CA-C-N 126.627 3.403 . . . . 0.0 113.442 167.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.91 92.61 3.74 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.562 -1.336 . . . . 0.0 114.206 -172.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 48.0 m -79.84 172.56 9.55 Favored Pre-proline 0 CA--C 1.586 2.331 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 159.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -71.93 78.95 1.71 Allowed 'Trans proline' 0 CA--C 1.574 2.5 0 CA-C-N 124.021 2.472 . . . . 0.0 114.84 175.015 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 CA--C 1.562 1.406 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 -161.265 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 49.7 tttm . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pp -147.44 164.94 20.39 Favored Pre-proline 0 CA--C 1.588 2.415 0 N-CA-C 113.457 0.91 . . . . 0.0 113.457 174.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -82.06 158.93 18.08 Favored 'Trans proline' 0 CA--C 1.587 3.127 0 N-CA-C 121.963 3.794 . . . . 0.0 121.963 -174.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.07 113.56 2.74 Favored 'Trans proline' 0 CA--C 1.564 2.019 0 C-N-CA 123.357 2.704 . . . . 0.0 112.611 -175.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 110.73 24.16 5.66 Favored Glycine 0 N--CA 1.492 2.429 0 N-CA-C 117.879 1.912 . . . . 0.0 117.879 -163.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.281 24.1 m95 -115.36 162.59 16.91 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-N 119.559 1.68 . . . . 0.0 114.21 175.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -145.38 -151.01 0.35 Allowed 'General case' 0 CA--C 1.573 1.861 0 CA-C-O 121.838 0.828 . . . . 0.0 112.09 150.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -146.77 118.18 7.92 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.637 -1.29 . . . . 0.0 111.759 -160.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 17.7 mtt-85 -137.32 113.94 10.32 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 119.992 -1.692 . . . . 0.0 112.923 -159.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -120.47 121.0 37.51 Favored 'General case' 0 CA--C 1.563 1.463 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -130.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' B' ' 16' ' ' ARG 0.279 5.4 t 71.05 132.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 N-CA-C 118.741 2.867 . . . . 0.0 118.741 163.697 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 21.3 mmt85 -124.87 -56.21 1.58 Allowed 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.297 -1.502 . . . . 0.0 112.424 157.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 97.0 p -74.74 -43.04 57.02 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 117.502 2.408 . . . . 0.0 117.502 179.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 58.1 m -158.47 -54.72 0.07 Allowed 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.929 -1.107 . . . . 0.0 112.401 -178.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -166.49 64.61 0.21 Allowed Glycine 0 N--CA 1.49 2.294 0 O-C-N 120.944 -1.097 . . . . 0.0 112.813 173.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.461 ' O ' ' HA ' ' B' ' 11' ' ' SER . 3.4 mpt_? -149.98 146.81 27.23 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 122.593 1.187 . . . . 0.0 112.636 -174.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.711 0.5 OUTLIER 79.73 130.69 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 120.882 -1.136 . . . . 0.0 112.641 -144.576 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.291 1.1 p90 -175.34 4.32 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.215 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -165.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 28.7 m-85 -143.33 141.13 30.86 Favored 'General case' 0 N--CA 1.511 2.613 0 CA-C-N 122.772 2.533 . . . . 0.0 112.801 177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 76.5 t80 -143.9 125.94 15.42 Favored 'General case' 0 N--CA 1.502 2.132 0 O-C-N 120.585 -1.322 . . . . 0.0 112.303 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -88.66 125.74 34.98 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 120.062 -1.649 . . . . 0.0 111.193 172.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 40.4 m-70 -77.68 -50.93 11.45 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 115.831 1.789 . . . . 0.0 115.831 175.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 24.4 mm -65.77 -46.38 89.08 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.409 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 58.4 m -62.54 -43.61 98.38 Favored 'General case' 0 CA--C 1.578 2.021 0 N-CA-C 116.06 1.874 . . . . 0.0 116.06 162.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.519 0.1 OUTLIER 75.79 74.85 0.09 Allowed 'General case' 0 CA--C 1.571 1.759 0 C-N-CA 125.656 1.583 . . . . 0.0 112.578 -163.588 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -141.43 109.59 5.85 Favored 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.017 -1.052 . . . . 0.0 111.263 -176.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 77.8 p -82.23 126.25 31.88 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.541 -0.725 . . . . 0.0 112.822 166.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . 0.402 ' HG3' ' H ' ' B' ' 30' ' ' GLU . 13.9 pt20 -146.32 170.14 17.39 Favored 'General case' 0 CA--C 1.565 1.524 0 CA-C-O 123.76 1.743 . . . . 0.0 114.913 -178.088 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.31 1.9 p-90 -115.96 43.23 2.17 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 116.07 1.878 . . . . 0.0 116.07 166.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.402 ' H ' ' HG3' ' B' ' 28' ' ' GLN . 0.0 OUTLIER -139.42 159.74 41.46 Favored 'General case' 0 N--CA 1.485 1.277 0 CA-C-O 123.125 1.44 . . . . 0.0 110.516 162.659 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.274 0.0 OUTLIER -90.48 142.71 28.38 Favored Pre-proline 0 CA--C 1.58 2.125 0 CA-C-N 114.829 -1.078 . . . . 0.0 112.469 166.387 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -60.15 -2.0 1.56 Allowed 'Trans proline' 0 CA--C 1.582 2.906 0 C-N-CA 123.589 2.859 . . . . 0.0 119.141 176.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.317 7.1 t 72.68 -65.01 0.37 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 116.335 1.976 . . . . 0.0 116.335 -177.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.81 61.47 1.94 Allowed Glycine 0 N--CA 1.493 2.473 0 N-CA-C 116.854 1.502 . . . . 0.0 116.854 -179.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 6.3 m120 -141.58 115.85 9.44 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 123.88 0.872 . . . . 0.0 109.227 175.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 84.0 p -83.52 78.59 9.64 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 113.847 1.055 . . . . 0.0 113.847 176.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 38.8 m -152.21 115.03 4.61 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 122.57 1.176 . . . . 0.0 108.574 164.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 94.3 p -148.88 101.36 3.17 Favored 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 114.665 -1.152 . . . . 0.0 109.383 177.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 CA-C-O 118.9 -0.944 . . . . 0.0 111.397 -178.495 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 49.6 tttp . . . . . 0 N--CA 1.495 1.806 0 CA-C-O 119.198 -0.429 . . . . 0.0 110.627 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.1 p -62.36 143.42 15.34 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 N-CA-C 114.054 1.131 . . . . 0.0 114.054 173.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 53.9 m -163.63 143.02 8.21 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.087 -1.008 . . . . 0.0 111.991 -175.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.9 p -76.29 94.87 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.023 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 178.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 4.0 t 65.58 106.1 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.505 2.325 0 C-N-CA 124.993 1.317 . . . . 0.0 112.64 170.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.0 162.47 13.21 Favored 'General case' 0 CA--C 1.573 1.836 0 N-CA-C 115.483 1.66 . . . . 0.0 115.483 -166.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.336 30.6 Cg_endo -73.2 -79.92 0.01 OUTLIER 'Trans proline' 0 CA--C 1.586 3.087 0 N-CA-C 118.702 2.539 . . . . 0.0 118.702 -172.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -66.52 142.32 64.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 CA-C-N 126.854 3.484 . . . . 0.0 115.149 -178.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -103.38 99.32 9.15 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 116.383 1.994 . . . . 0.0 116.383 -157.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 23.9 t -63.64 134.8 96.01 Favored Pre-proline 0 CA--C 1.585 2.305 0 CA-C-O 117.39 -1.291 . . . . 0.0 112.678 107.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -53.09 -60.54 0.68 Allowed 'Trans proline' 0 CA--C 1.57 2.297 0 C-N-CA 123.123 2.549 . . . . 0.0 116.203 -176.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 71.6 m . . . . . 0 N--CA 1.484 1.23 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 140.066 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 tptp . . . . . 0 N--CA 1.495 1.82 0 N-CA-C 111.025 0.009 . . . . 0.0 111.025 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -68.7 174.55 2.55 Favored Pre-proline 0 CA--C 1.589 2.452 0 N-CA-C 115.333 1.605 . . . . 0.0 115.333 165.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -72.92 157.08 51.95 Favored 'Trans proline' 0 CA--C 1.589 3.238 0 N-CA-C 121.782 3.724 . . . . 0.0 121.782 -174.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -72.21 135.01 24.04 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 C-N-CA 123.278 2.652 . . . . 0.0 113.123 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 81.7 27.77 45.45 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 118.821 2.289 . . . . 0.0 118.821 -165.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.28 23.1 m95 -111.3 162.53 14.91 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-N 120.004 1.902 . . . . 0.0 114.083 170.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.71 -155.15 0.59 Allowed 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 122.193 0.997 . . . . 0.0 112.505 149.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -144.33 120.37 10.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.913 -1.117 . . . . 0.0 111.567 -159.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.1 mtt-85 -136.66 115.74 12.43 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.24 -1.537 . . . . 0.0 113.338 -160.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.7 mtp -108.89 107.05 17.29 Favored 'General case' 0 N--CA 1.491 1.589 0 N-CA-C 115.344 1.609 . . . . 0.0 115.344 -158.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . 0.559 ' H ' ' HB ' ' B' ' 17' ' ' VAL 0.285 5.8 p 65.93 -163.1 0.25 Allowed 'General case' 0 CA--C 1.579 2.076 0 N-CA-C 117.143 2.275 . . . . 0.0 117.143 164.262 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 47.0 mtt-85 -124.87 -75.18 0.6 Allowed 'General case' 0 CA--C 1.57 1.717 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 165.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 77.4 p -139.63 85.95 2.08 Favored 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 144.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 21.0 m -155.7 -27.69 0.1 Allowed 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 -158.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 82.19 44.32 7.61 Favored Glycine 0 N--CA 1.499 2.847 0 CA-C-N 121.213 1.824 . . . . 0.0 115.638 -170.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 6.0 mpt_? -137.57 172.5 12.87 Favored 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 124.494 1.118 . . . . 0.0 111.157 178.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.559 ' HB ' ' H ' ' B' ' 11' ' ' SER 0.535 2.2 t 71.82 141.44 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.58 2.122 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 160.949 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.279 3.0 p90 -170.39 10.48 0.02 OUTLIER 'General case' 0 CA--C 1.575 1.93 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 -171.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -148.86 145.52 27.52 Favored 'General case' 0 N--CA 1.504 2.248 0 CA-C-N 123.183 2.719 . . . . 0.0 113.602 -176.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 75.5 t80 -151.7 127.2 10.05 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.899 -1.126 . . . . 0.0 111.135 177.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -94.6 126.66 40.04 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 120.216 -1.552 . . . . 0.0 111.003 170.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 54.7 m-70 -79.14 -45.79 19.28 Favored 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 115.125 1.528 . . . . 0.0 115.125 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 3.6 mt -66.81 -51.78 51.91 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.245 0 C-N-CA 124.302 1.041 . . . . 0.0 112.96 -177.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 85.7 m -56.65 -46.13 81.22 Favored 'General case' 0 CA--C 1.577 2.018 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 163.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.523 0.0 OUTLIER 76.21 65.98 0.06 Allowed 'General case' 0 CA--C 1.575 1.934 0 C-N-CA 125.462 1.505 . . . . 0.0 112.302 -163.72 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -125.09 122.7 37.95 Favored 'General case' 0 CA--C 1.557 1.222 0 O-C-N 121.185 -0.947 . . . . 0.0 110.418 -179.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 21.8 p -99.69 121.43 41.22 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.973 -0.455 . . . . 0.0 110.937 167.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -153.51 171.1 19.24 Favored 'General case' 0 CA--C 1.562 1.407 0 CA-C-O 123.364 1.554 . . . . 0.0 113.21 -164.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.314 0.6 OUTLIER -127.11 51.1 1.91 Allowed 'General case' 0 CA--C 1.567 1.601 0 O-C-N 121.12 -0.988 . . . . 0.0 113.251 166.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -135.93 140.15 43.8 Favored 'General case' 0 CA--C 1.56 1.353 0 CA-C-O 122.238 1.018 . . . . 0.0 110.593 -178.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 52.8 ttp85 -81.26 128.12 71.51 Favored Pre-proline 0 CA--C 1.576 1.961 0 CA-C-O 117.416 -1.278 . . . . 0.0 112.83 171.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -61.25 6.5 0.14 Allowed 'Trans proline' 0 CA--C 1.581 2.843 0 N-CA-C 120.03 3.05 . . . . 0.0 120.03 179.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.384 37.7 p 78.77 -63.31 0.29 Allowed 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 116.082 1.882 . . . . 0.0 116.082 -175.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.33 -73.47 0.51 Allowed Glycine 0 N--CA 1.493 2.442 0 CA-C-N 118.697 0.681 . . . . 0.0 113.573 -165.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 66.8 m-80 -90.87 86.42 6.3 Favored 'General case' 0 N--CA 1.493 1.725 0 CA-C-O 121.502 0.668 . . . . 0.0 110.274 171.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 44.1 t -84.99 65.38 9.21 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 -173.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 79.8 p -90.47 104.88 17.41 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 122.39 1.09 . . . . 0.0 112.486 171.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 70.4 m -112.71 -58.83 2.09 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 113.433 -1.712 . . . . 0.0 112.484 174.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.55 0 N-CA-C 110.625 -0.99 . . . . 0.0 110.625 176.234 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.5 tttp . . . . . 0 N--CA 1.497 1.888 0 N-CA-C 108.51 -0.922 . . . . 0.0 108.51 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . 0.523 28.6 m 56.52 -95.31 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 CA-C-N 119.194 0.907 . . . . 0.0 112.211 -154.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . 0.373 82.2 p 70.14 -42.4 0.51 Allowed 'General case' 0 N--CA 1.502 2.126 0 N-CA-C 120.844 3.646 . . . . 0.0 120.844 155.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 75.3 t -83.29 98.37 5.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 CA-C-N 120.61 1.55 . . . . 0.0 109.76 179.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 24.8 t -77.05 116.58 20.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 CA-C-O 122.036 0.922 . . . . 0.0 109.004 177.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 16.2 mtp-105 -97.16 145.44 26.02 Favored 'General case' 0 CA--C 1.568 1.636 0 CA-C-O 122.322 1.058 . . . . 0.0 113.782 -171.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.277 24.3 Cg_endo -62.12 -52.53 2.67 Favored 'Trans proline' 0 CA--C 1.575 2.566 0 C-N-CA 123.053 2.502 . . . . 0.0 117.265 -171.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -70.83 -103.26 0.01 OUTLIER 'Trans proline' 0 CA--C 1.577 2.666 0 CA-C-N 125.086 2.852 . . . . 0.0 112.267 162.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -161.47 171.02 18.87 Favored 'General case' 0 CA--C 1.577 1.994 0 CA-C-N 119.613 1.097 . . . . 0.0 112.014 167.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 76.2 p -49.99 155.94 1.45 Allowed Pre-proline 0 CA--C 1.582 2.203 0 N-CA-C 117.015 2.228 . . . . 0.0 117.015 157.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -60.05 -54.23 2.46 Favored 'Trans proline' 0 CA--C 1.572 2.383 0 CA-C-N 123.484 2.28 . . . . 0.0 115.915 173.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 80.2 p . . . . . 0 N--CA 1.486 1.368 0 C-N-CA 123.208 0.603 . . . . 0.0 112.122 158.048 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 10.5 pttp . . . . . 0 CA--C 1.576 1.956 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp -72.3 171.07 10.52 Favored Pre-proline 0 CA--C 1.589 2.469 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 163.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -73.31 154.83 51.41 Favored 'Trans proline' 0 CA--C 1.59 3.306 0 N-CA-C 122.118 3.853 . . . . 0.0 122.118 -172.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -71.62 129.41 15.61 Favored 'Trans proline' 0 CA--C 1.567 2.166 0 C-N-CA 122.96 2.44 . . . . 0.0 113.009 173.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.6 33.64 7.84 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 117.322 1.689 . . . . 0.0 117.322 -160.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 30.0 m95 -123.4 169.87 10.92 Favored 'General case' 0 CA--C 1.562 1.406 0 CA-C-N 120.362 2.081 . . . . 0.0 116.477 171.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -149.07 178.81 8.39 Favored 'General case' 0 CA--C 1.57 1.723 0 CA-C-O 124.12 1.914 . . . . 0.0 111.836 144.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . 0.271 0.2 OUTLIER -100.42 127.08 46.84 Favored 'General case' 0 CA--C 1.573 1.828 0 CA-C-N 114.135 -1.393 . . . . 0.0 112.406 169.188 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 77.1 mmt-85 -129.61 126.19 37.88 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 120.228 -1.545 . . . . 0.0 109.699 -170.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 86.3 mmm -112.77 136.0 52.88 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 116.156 1.91 . . . . 0.0 116.156 -156.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . 0.432 ' H ' ' HB ' ' B' ' 17' ' ' VAL 0.261 24.3 p 47.86 61.17 3.1 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 121.342 3.83 . . . . 0.0 121.342 137.5 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 29.1 ptt180 -71.31 -15.48 62.41 Favored 'General case' 0 CA--C 1.582 2.18 0 N-CA-C 117.325 2.343 . . . . 0.0 117.325 165.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 22.9 t -131.15 174.66 9.81 Favored 'General case' 0 CA--C 1.578 2.036 0 O-C-N 120.871 -1.143 . . . . 0.0 110.433 155.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 14.7 t -68.75 96.3 0.73 Allowed 'General case' 0 CA--C 1.57 1.729 0 N-CA-C 115.61 1.708 . . . . 0.0 115.61 -164.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.02 55.08 1.91 Allowed Glycine 0 N--CA 1.492 2.417 0 N-CA-C 115.49 0.956 . . . . 0.0 115.49 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -141.19 163.73 32.18 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.12 0.968 . . . . 0.0 110.398 178.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.432 ' HB ' ' H ' ' B' ' 11' ' ' SER 0.483 1.6 t 66.23 132.79 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.579 2.089 0 N-CA-C 116.718 2.118 . . . . 0.0 116.718 162.345 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.337 6.5 p90 -165.8 2.57 0.03 OUTLIER 'General case' 0 CA--C 1.572 1.82 0 O-C-N 119.717 -1.864 . . . . 0.0 116.016 -171.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -144.01 156.77 44.52 Favored 'General case' 0 N--CA 1.502 2.148 0 CA-C-N 122.793 2.542 . . . . 0.0 114.142 178.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -161.75 129.75 4.16 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.294 -1.504 . . . . 0.0 109.441 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -83.65 125.61 32.03 Favored 'General case' 0 CA--C 1.576 1.943 0 O-C-N 120.106 -1.621 . . . . 0.0 110.645 168.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -81.75 -45.36 15.76 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 116.899 2.185 . . . . 0.0 116.899 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 25.4 pt -67.12 -33.5 63.52 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.243 0 N-CA-C 116.004 1.853 . . . . 0.0 116.004 179.243 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 69.9 p -74.43 -49.59 21.84 Favored 'General case' 0 N--CA 1.501 2.118 0 N-CA-C 114.773 1.398 . . . . 0.0 114.773 158.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.329 0.8 OUTLIER 82.6 58.83 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.996 0 C-N-CA 125.93 1.692 . . . . 0.0 112.592 -163.791 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -117.91 123.69 46.43 Favored 'General case' 0 CA--C 1.563 1.474 0 O-C-N 121.262 -0.899 . . . . 0.0 111.265 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 28.0 m -88.91 134.03 34.1 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.311 -0.868 . . . . 0.0 112.646 175.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -147.61 172.05 14.63 Favored 'General case' 0 CA--C 1.572 1.805 0 CA-C-O 123.73 1.728 . . . . 0.0 113.424 -175.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -121.92 60.62 0.97 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.314 -1.491 . . . . 0.0 110.358 163.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -156.77 130.18 8.07 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-O 121.977 0.894 . . . . 0.0 111.28 -152.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 58.1 ttt-85 -93.77 132.78 29.08 Favored Pre-proline 0 CA--C 1.573 1.852 0 CA-C-O 117.454 -1.26 . . . . 0.0 113.168 -175.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 15.1 Cg_endo -64.76 11.11 0.12 Allowed 'Trans proline' 0 CA--C 1.58 2.782 0 N-CA-C 119.499 2.846 . . . . 0.0 119.499 178.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.32 9.7 t 73.6 -70.58 0.15 Allowed 'General case' 0 N--CA 1.496 1.872 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 179.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 97.89 -67.04 0.78 Allowed Glycine 0 N--CA 1.492 2.388 0 O-C-N 121.729 -0.607 . . . . 0.0 113.957 -157.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -84.73 123.64 30.62 Favored 'General case' 0 CA--C 1.571 1.781 0 O-C-N 122.482 -0.423 . . . . 0.0 112.018 170.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 25.6 t -107.51 34.24 3.62 Favored 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 116.332 1.975 . . . . 0.0 116.332 168.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 51.1 m -151.11 114.49 4.84 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 119.99 -1.694 . . . . 0.0 109.092 157.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 48.4 t -140.97 -75.26 0.32 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.831 178.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.672 0 N-CA-C 109.716 -1.354 . . . . 0.0 109.716 -138.586 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 97.5 mttt . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 118.605 -0.712 . . . . 0.0 109.468 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 9.4 p -149.5 140.39 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.175 0 CA-C-N 119.664 1.12 . . . . 0.0 110.461 -178.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.8 m -88.97 94.35 9.92 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.297 -0.877 . . . . 0.0 111.046 168.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.253 12.3 p -76.78 85.08 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 N-CA-C 113.751 1.019 . . . . 0.0 113.751 -170.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.435 HG11 ' HD2' ' B' ' 9' ' ' ARG 0.258 13.6 t 71.49 119.08 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 C-N-CA 124.542 1.137 . . . . 0.0 110.063 -167.533 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -141.54 130.85 23.59 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 122.128 0.966 . . . . 0.0 112.607 -172.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TPO . . . . . 1.333 ' O3P' ' HB3' ' B' ' 16' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -63.33 -47.94 6.94 Favored 'Trans proline' 0 CA--C 1.575 2.555 0 C-N-CA 123.188 2.592 . . . . 0.0 118.804 -175.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -66.03 -63.68 0.06 OUTLIER 'Trans proline' 0 CA--C 1.57 2.282 0 CA-C-N 125.886 3.138 . . . . 0.0 115.532 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? -154.78 142.57 19.97 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.027 -1.046 . . . . 0.0 112.127 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.8 m -56.07 143.99 60.86 Favored Pre-proline 0 CA--C 1.58 2.113 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 165.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . 0.351 0.3 OUTLIER 4.17 70.03 0.0 OUTLIER 'Trans proline' 0 CA--C 1.561 1.839 2 N-CA-C 123.911 4.543 . . . . 0.0 123.911 -148.609 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.448 ' C ' HH21 ' B' ' 16' ' ' ARG . 37.7 t . . . . . 0 C--O 1.253 1.284 0 O-C-N 121.208 -0.933 . . . . 0.0 110.218 129.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 117.056 -1.45 . . . . 0.0 111.652 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . 0.324 1.2 pp 47.82 175.76 0.01 OUTLIER Pre-proline 0 N--CA 1.51 2.559 0 N-CA-C 120.16 3.392 . . . . 0.0 120.16 175.906 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -78.94 158.05 27.3 Favored 'Trans proline' 0 CA--C 1.587 3.15 0 N-CA-C 122.126 3.856 . . . . 0.0 122.126 -179.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.74 127.02 8.48 Favored 'Trans proline' 0 CA--C 1.563 1.965 0 C-N-CA 123.271 2.648 . . . . 0.0 113.133 -177.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.21 23.82 16.14 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 118.095 1.998 . . . . 0.0 118.095 -163.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.283 22.1 m95 -119.52 169.28 10.19 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-N 120.87 2.335 . . . . 0.0 115.848 178.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -134.71 164.88 26.54 Favored 'General case' 0 CA--C 1.564 1.502 0 CA-C-O 124.957 2.313 . . . . 0.0 113.731 151.156 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.33 123.89 30.08 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-N 112.783 -2.008 . . . . 0.0 110.177 142.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . 0.611 ' O ' HG13 ' B' ' 17' ' ' VAL . 2.7 mtt-85 -122.77 102.38 8.0 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 121.684 2.038 . . . . 0.0 110.599 -173.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.43 115.18 29.7 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -155.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 26.5 p 67.7 131.29 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.611 2.449 . . . . 0.0 117.611 168.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.61 -68.92 0.56 Allowed 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.587 -1.321 . . . . 0.0 107.643 160.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 88.8 p -93.88 111.16 22.82 Favored 'General case' 0 CA--C 1.572 1.815 0 O-C-N 120.819 -1.175 . . . . 0.0 112.706 166.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . 0.278 38.8 p 63.88 40.27 7.57 Favored 'General case' 0 N--CA 1.504 2.269 0 N-CA-C 119.885 3.291 . . . . 0.0 119.885 169.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 78.73 33.11 38.86 Favored Glycine 0 N--CA 1.496 2.64 0 N-CA-C 117.244 1.658 . . . . 0.0 117.244 175.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 1.333 ' HB3' ' O3P' ' A' ' 7' ' ' TPO . 9.4 mpt_? -116.96 126.08 52.39 Favored 'General case' 0 CA--C 1.565 1.552 0 CA-C-N 118.487 1.143 . . . . 0.0 111.236 -171.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.611 HG13 ' O ' ' B' ' 9' ' ' ARG 0.846 0.7 OUTLIER 110.4 148.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.231 0 C-N-CA 126.417 1.887 . . . . 0.0 114.565 -179.131 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.394 10.2 p90 -170.46 12.23 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.252 0 C-N-CA 126.272 1.829 . . . . 0.0 115.383 176.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -148.47 137.67 21.84 Favored 'General case' 0 N--CA 1.501 2.116 0 CA-C-N 122.364 2.347 . . . . 0.0 111.986 165.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -143.02 135.45 27.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 119.637 -1.914 . . . . 0.0 110.844 173.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.22 120.55 31.47 Favored 'General case' 0 CA--C 1.57 1.739 0 O-C-N 120.203 -1.561 . . . . 0.0 110.536 169.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -76.7 -43.97 35.47 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 117.117 2.265 . . . . 0.0 117.117 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 26.5 pt -71.64 -35.98 57.87 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 N-CA-C 115.711 1.745 . . . . 0.0 115.711 -178.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 80.4 p -71.36 -50.76 29.0 Favored 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 159.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.317 34.7 t-20 83.72 64.74 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.959 0 C-N-CA 126.115 1.766 . . . . 0.0 112.162 -163.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -128.49 118.75 23.6 Favored 'General case' 0 CA--C 1.564 1.498 0 C-N-CA 123.514 0.726 . . . . 0.0 111.455 177.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 89.6 p -86.42 128.23 34.92 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.157 -0.964 . . . . 0.0 113.301 171.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -137.72 177.8 7.59 Favored 'General case' 0 CA--C 1.567 1.629 0 CA-C-O 123.031 1.396 . . . . 0.0 111.887 175.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.366 0.1 OUTLIER -128.74 47.09 2.5 Favored 'General case' 0 CA--C 1.571 1.785 0 O-C-N 119.794 -1.816 . . . . 0.0 114.097 164.092 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -147.56 160.38 42.7 Favored 'General case' 0 CA--C 1.573 1.865 0 CA-C-O 125.329 2.49 . . . . 0.0 109.587 167.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.313 17.7 ttp-105 -64.53 155.87 79.56 Favored Pre-proline 0 CA--C 1.569 1.709 0 CA-C-N 112.842 -1.981 . . . . 0.0 116.239 171.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.21 65.7 1.46 Allowed 'Trans proline' 0 CA--C 1.573 2.429 0 C-N-CA 122.233 1.955 . . . . 0.0 112.258 154.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 58.4 m -53.02 -13.36 0.44 Allowed 'General case' 0 CA--C 1.574 1.883 0 N-CA-C 119.841 3.275 . . . . 0.0 119.841 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -95.22 57.74 1.72 Allowed Glycine 0 N--CA 1.494 2.507 0 CA-C-N 119.387 0.994 . . . . 0.0 115.255 171.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -134.24 98.63 4.16 Favored 'General case' 0 CA--C 1.566 1.562 0 C-N-CA 123.058 0.543 . . . . 0.0 110.098 -172.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 22.7 t -79.59 161.29 26.02 Favored 'General case' 0 CA--C 1.571 1.772 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 176.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 64.9 m -89.8 62.44 5.74 Favored 'General case' 0 N--CA 1.503 2.211 0 CA-C-O 124.525 2.107 . . . . 0.0 114.243 169.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 80.3 p -171.92 -42.7 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 112.554 -2.112 . . . . 0.0 115.03 -162.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 N-CA-C 107.857 -2.097 . . . . 0.0 107.857 -133.204 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.2 tptp . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 118.882 -0.58 . . . . 0.0 110.488 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 11.5 t -136.72 52.4 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.518 0 CA-C-N 119.692 1.133 . . . . 0.0 109.84 167.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.8 t -174.06 155.37 2.48 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 120.024 -1.672 . . . . 0.0 112.201 -174.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.318 3.3 t 75.75 127.75 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.349 0 N-CA-C 114.372 1.249 . . . . 0.0 114.372 162.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.0 t -116.86 128.41 74.25 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.261 0 C-N-CA 124.123 0.969 . . . . 0.0 109.075 -179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -135.65 159.43 41.64 Favored 'General case' 0 N--CA 1.504 2.266 0 N-CA-C 117.507 2.41 . . . . 0.0 117.507 -160.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TPO . . . . . 0.558 ' O2P' ' O ' ' A' ' 13' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -70.14 -63.53 0.04 OUTLIER 'Trans proline' 0 CA--C 1.578 2.698 0 C-N-CA 123.099 2.532 . . . . 0.0 117.497 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -72.86 92.5 0.79 Allowed 'Trans proline' 0 CA--C 1.566 2.082 0 CA-C-N 125.566 3.023 . . . . 0.0 111.589 171.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.71 104.02 0.1 Allowed 'General case' 0 CA--C 1.571 1.759 0 CA-C-N 113.519 -1.673 . . . . 0.0 114.664 -165.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.4 m -83.51 177.56 2.93 Favored Pre-proline 0 CA--C 1.581 2.157 0 N-CA-C 115.059 1.503 . . . . 0.0 115.059 -168.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -54.66 -13.99 6.73 Favored 'Trans proline' 0 CA--C 1.577 2.63 0 N-CA-C 119.908 3.003 . . . . 0.0 119.908 167.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.558 ' O ' ' O2P' ' A' ' 7' ' ' TPO . 58.1 m . . . . . 0 N--CA 1.485 1.304 0 O-C-N 120.704 -1.248 . . . . 0.0 109.98 161.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 9.5 tmtt? . . . . . 0 CA--C 1.572 1.814 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -67.87 169.17 10.23 Favored Pre-proline 0 CA--C 1.588 2.42 0 N-CA-C 116.363 1.986 . . . . 0.0 116.363 177.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_exo -70.88 153.61 63.7 Favored 'Trans proline' 0 CA--C 1.588 3.191 0 N-CA-C 122.157 3.868 . . . . 0.0 122.157 -172.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -74.21 126.74 10.68 Favored 'Trans proline' 0 CA--C 1.566 2.096 0 C-N-CA 123.183 2.589 . . . . 0.0 112.664 175.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.89 28.36 10.17 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 117.69 1.836 . . . . 0.0 117.69 -161.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.254 12.6 m95 -114.54 162.96 16.04 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 120.276 2.038 . . . . 0.0 114.072 171.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -153.92 141.38 19.74 Favored 'General case' 0 CA--C 1.559 1.319 0 CA-C-O 123.285 1.517 . . . . 0.0 114.916 152.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.44 128.17 35.82 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 166.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.7 mtt-85 -129.59 106.88 9.04 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-N 120.494 1.497 . . . . 0.0 111.441 -174.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 3.2 ttm -114.82 129.3 56.67 Favored 'General case' 0 CA--C 1.564 1.509 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -132.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.344 24.5 p 78.42 157.85 0.17 Allowed 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 117.883 2.549 . . . . 0.0 117.883 154.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -151.42 -50.55 0.12 Allowed 'General case' 0 CA--C 1.57 1.748 0 C-N-CA 124.524 1.13 . . . . 0.0 112.318 176.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 93.2 p -100.16 -61.89 1.31 Allowed 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.0 112.786 157.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 97.3 p -119.15 -59.49 1.84 Allowed 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 179.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -163.52 45.28 0.32 Allowed Glycine 0 N--CA 1.494 2.54 0 N-CA-C 116.863 1.505 . . . . 0.0 116.863 -177.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -116.12 144.32 44.3 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.548 1.139 . . . . 0.0 113.303 169.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . 0.731 0.5 OUTLIER 73.45 124.84 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 CA-C-N 115.274 -0.875 . . . . 0.0 112.416 -142.68 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.308 9.8 p90 -172.29 18.3 0.01 OUTLIER 'General case' 0 CA--C 1.581 2.16 0 CA-C-O 116.08 -1.914 . . . . 0.0 114.841 -174.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -153.85 148.79 26.66 Favored 'General case' 0 N--CA 1.514 2.765 0 CA-C-N 124.357 3.253 . . . . 0.0 115.591 174.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -161.48 136.55 7.44 Favored 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 125.903 1.681 . . . . 0.0 109.123 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.12 128.47 44.07 Favored 'General case' 0 CA--C 1.571 1.752 0 O-C-N 120.27 -1.519 . . . . 0.0 110.642 172.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -75.16 -55.83 5.33 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.162 -1.586 . . . . 0.0 114.163 174.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 32.7 pt -60.64 -35.16 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.01 0 N-CA-C 117.349 2.351 . . . . 0.0 117.349 -178.21 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -93.36 -17.42 23.57 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 164.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.326 3.0 t-20 64.59 24.44 13.02 Favored 'General case' 0 CA--C 1.579 2.078 0 N-CA-C 116.644 2.091 . . . . 0.0 116.644 -164.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.54 150.73 43.27 Favored 'General case' 0 CA--C 1.573 1.863 0 O-C-N 119.599 -1.938 . . . . 0.0 114.273 164.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 4.4 m -152.56 122.09 6.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 119.964 -1.71 . . . . 0.0 111.2 -170.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -162.55 177.08 9.76 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-O 124.051 1.882 . . . . 0.0 112.952 -150.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.273 0.1 OUTLIER -119.01 39.44 3.54 Favored 'General case' 0 CA--C 1.577 1.995 0 CA-C-N 114.558 -1.201 . . . . 0.0 112.824 155.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -127.13 134.14 50.25 Favored 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 122.394 1.093 . . . . 0.0 110.396 -167.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 41.0 ttp180 -90.56 123.97 63.84 Favored Pre-proline 0 CA--C 1.574 1.903 0 CA-C-O 117.897 -1.049 . . . . 0.0 113.512 -172.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -60.02 -39.83 66.89 Favored 'Trans proline' 0 CA--C 1.569 2.261 0 N-CA-C 117.845 2.21 . . . . 0.0 117.845 171.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.34 1.2 m 86.18 -49.81 0.06 Allowed 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 125.134 1.374 . . . . 0.0 114.606 -165.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 82.95 -75.06 2.43 Favored Glycine 0 N--CA 1.495 2.601 0 N-CA-C 116.576 1.39 . . . . 0.0 116.576 -177.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 31.9 m120 -75.8 -13.02 60.28 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 118.086 2.625 . . . . 0.0 118.086 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . 0.266 10.9 t 58.8 23.1 10.86 Favored 'General case' 0 N--CA 1.504 2.23 0 N-CA-C 119.132 3.012 . . . . 0.0 119.132 -174.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 52.5 m -152.46 112.45 4.0 Favored 'General case' 0 CA--C 1.562 1.404 0 O-C-N 120.453 -1.404 . . . . 0.0 107.934 160.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 85.7 p -163.0 -52.36 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.911 0 CA-C-N 114.265 -1.334 . . . . 0.0 113.891 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 108.672 -1.771 . . . . 0.0 108.672 -141.362 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.763 0 CA-C-O 118.85 -0.595 . . . . 0.0 110.116 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 10.0 p -76.46 140.16 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.22 0 CA-C-N 120.0 1.273 . . . . 0.0 113.734 179.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 58.2 m -106.37 77.86 1.24 Allowed 'General case' 0 N--CA 1.499 1.996 0 O-C-N 120.685 -1.259 . . . . 0.0 111.191 167.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 10.7 p -80.85 105.03 10.21 Favored 'Isoleucine or valine' 0 CA--C 1.574 1.892 0 C-N-CA 123.737 0.815 . . . . 0.0 111.883 -179.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.333 2.4 t 73.6 111.86 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 C-N-CA 124.338 1.055 . . . . 0.0 110.906 -173.661 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . 0.264 24.2 ptt-85 -146.43 -166.2 2.42 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 119.878 -1.763 . . . . 0.0 115.759 -156.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.293 18.1 Cg_endo -71.62 -68.53 0.02 OUTLIER 'Trans proline' 0 CA--C 1.582 2.912 0 N-CA-C 119.548 2.865 . . . . 0.0 119.548 -175.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.1 Cg_endo -70.37 -49.31 0.48 Allowed 'Trans proline' 0 CA--C 1.567 2.127 0 CA-C-N 126.187 3.245 . . . . 0.0 117.487 -174.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.42 162.17 41.31 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.912 -1.118 . . . . 0.0 111.912 165.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 27.5 t -36.69 149.06 0.17 Allowed Pre-proline 0 CA--C 1.594 2.654 0 N-CA-C 120.851 3.649 . . . . 0.0 120.851 178.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -66.73 -33.71 33.9 Favored 'Trans proline' 0 CA--C 1.57 2.298 0 C-N-CA 123.441 2.761 . . . . 0.0 117.256 173.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 74.8 m . . . . . 0 N--CA 1.488 1.433 0 O-C-N 121.618 -0.676 . . . . 0.0 110.254 150.49 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 20.4 tptm . . . . . 0 CA--C 1.577 2.006 0 CA-C-O 120.941 0.401 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 2.2 pp -144.59 176.28 2.33 Favored Pre-proline 0 CA--C 1.587 2.38 0 C-N-CA 124.471 1.109 . . . . 0.0 109.485 164.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -76.13 157.32 38.07 Favored 'Trans proline' 0 CA--C 1.584 3.016 0 N-CA-C 121.21 3.504 . . . . 0.0 121.21 -177.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -79.19 124.33 5.95 Favored 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.117 2.545 . . . . 0.0 112.879 -176.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.39 30.7 9.62 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 117.944 1.937 . . . . 0.0 117.944 -164.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . 0.504 ' CZ2' ' HG3' ' B' ' 32' ' ' PRO 0.268 22.4 m95 -114.13 162.82 16.02 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.506 1.653 . . . . 0.0 114.102 170.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -147.75 -148.62 0.26 Allowed 'General case' 0 CA--C 1.573 1.83 0 CA-C-O 121.93 0.871 . . . . 0.0 112.468 149.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -144.77 118.24 9.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.76 -1.212 . . . . 0.0 111.157 -161.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 21.0 mtt-85 -140.75 121.72 14.58 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.184 -1.573 . . . . 0.0 112.075 -161.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 25.5 mtp -113.18 142.33 45.9 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 118.355 2.724 . . . . 0.0 118.355 -150.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . 0.301 46.7 m 65.57 62.11 0.67 Allowed 'General case' 0 N--CA 1.496 1.835 0 N-CA-C 118.495 2.776 . . . . 0.0 118.495 155.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . 0.463 ' H ' HG12 ' B' ' 17' ' ' VAL . 16.0 mtp180 -65.75 -29.26 69.75 Favored 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 115.759 1.763 . . . . 0.0 115.759 156.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 74.9 m -133.63 136.78 45.04 Favored 'General case' 0 CA--C 1.563 1.469 0 O-C-N 120.477 -1.39 . . . . 0.0 108.588 156.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 49.9 m -35.23 102.26 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 119.068 2.988 . . . . 0.0 119.068 -165.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . 99.18 -0.4 57.27 Favored Glycine 0 N--CA 1.494 2.537 0 N-CA-C 119.047 2.379 . . . . 0.0 119.047 -173.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.2 mpp_? -127.59 128.15 45.08 Favored 'General case' 0 CA--C 1.566 1.581 0 CA-C-N 120.484 2.142 . . . . 0.0 112.371 -166.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.463 HG12 ' H ' ' B' ' 12' ' ' ARG 0.82 0.3 OUTLIER 99.46 135.45 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 C-N-CA 125.892 1.677 . . . . 0.0 112.217 -160.199 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.3 2.5 p90 -173.74 9.49 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.325 0 C-N-CA 126.184 1.794 . . . . 0.0 115.712 -170.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -147.27 144.92 29.19 Favored 'General case' 0 N--CA 1.511 2.603 0 CA-C-N 122.673 2.488 . . . . 0.0 112.982 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -152.89 129.79 10.98 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 120.137 -1.602 . . . . 0.0 112.666 -179.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.71 125.04 37.15 Favored 'General case' 0 CA--C 1.573 1.831 0 O-C-N 120.197 -1.564 . . . . 0.0 111.063 168.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 47.1 m-70 -68.6 -42.5 78.07 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 115.678 1.732 . . . . 0.0 115.678 173.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 9.0 mt -71.4 -54.84 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.166 0.986 . . . . 0.0 112.763 -171.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' THR . . . . . 0.589 HG23 ' H ' ' B' ' 26' ' ' ALA . 9.1 t -81.33 -15.98 53.74 Favored 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 118.171 2.656 . . . . 0.0 118.171 171.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.285 6.4 t-20 61.9 17.47 8.94 Favored 'General case' 0 CA--C 1.582 2.193 0 N-CA-C 116.265 1.95 . . . . 0.0 116.265 -160.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . 0.589 ' H ' HG23 ' B' ' 24' ' ' THR . . . -58.9 96.85 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 O-C-N 119.874 -1.766 . . . . 0.0 113.29 162.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 9.3 m -113.59 122.75 48.15 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -170.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -156.86 163.69 38.91 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 124.154 1.931 . . . . 0.0 115.074 -154.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -102.42 49.12 0.85 Allowed 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 113.846 -1.524 . . . . 0.0 112.378 168.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -161.04 138.77 9.33 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-O 123.092 1.425 . . . . 0.0 111.045 -148.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 68.8 ttt-85 -107.33 112.54 62.67 Favored Pre-proline 0 CA--C 1.573 1.839 0 CA-C-O 117.772 -1.109 . . . . 0.0 112.884 -155.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . 0.504 ' HG3' ' CZ2' ' B' ' 6' ' ' TRP . 39.2 Cg_endo -68.36 -48.5 1.17 Allowed 'Trans proline' 0 CA--C 1.575 2.549 0 C-N-CA 122.408 2.072 . . . . 0.0 115.335 174.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t 69.31 -47.97 0.59 Allowed 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 118.828 2.899 . . . . 0.0 118.828 177.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . 87.24 -53.01 4.4 Favored Glycine 0 N--CA 1.495 2.604 0 O-C-N 120.715 -1.241 . . . . 0.0 115.848 -164.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 29.4 m120 -123.35 132.2 53.9 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 161.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . 0.343 45.5 m 124.87 -68.23 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.426 0 C-N-CA 127.554 2.342 . . . . 0.0 110.896 -168.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 38.2 m -87.57 61.58 6.61 Favored 'General case' 0 N--CA 1.504 2.261 0 CA-C-O 124.508 2.099 . . . . 0.0 113.068 176.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 15.1 t 170.23 -60.91 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.72 -2.036 . . . . 0.0 110.326 -145.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.605 0 N-CA-C 107.387 -2.285 . . . . 0.0 107.387 -131.909 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.1 tmtt? . . . . . 0 CA--C 1.576 1.979 0 N-CA-C 111.636 0.235 . . . . 0.0 111.636 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 84.1 t -83.82 140.33 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.151 0 CA-C-O 122.161 0.982 . . . . 0.0 112.306 -178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.0 t -132.61 85.42 2.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.005 -1.059 . . . . 0.0 108.782 160.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . 0.296 22.3 t 73.05 141.35 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.445 0 C-N-CA 124.381 1.073 . . . . 0.0 111.578 -164.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 89.6 t -82.8 80.59 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.305 0 O-C-N 119.517 -1.989 . . . . 0.0 110.132 170.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.14 170.06 9.39 Favored 'General case' 0 CA--C 1.574 1.888 0 CA-C-N 113.435 -1.711 . . . . 0.0 115.099 -172.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TPO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . 0.253 6.3 Cg_exo -64.6 -59.18 0.18 Allowed 'Trans proline' 0 CA--C 1.573 2.442 0 C-N-CA 123.325 2.684 . . . . 0.0 118.524 169.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -80.25 -111.61 0.01 OUTLIER 'Trans proline' 0 CA--C 1.572 2.397 0 CA-C-N 125.343 2.944 . . . . 0.0 112.507 -179.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.39 102.77 3.63 Favored 'General case' 0 CA--C 1.568 1.648 0 O-C-N 120.317 -1.489 . . . . 0.0 110.388 172.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . 0.256 89.3 p -35.51 168.65 0.02 OUTLIER Pre-proline 0 CA--C 1.587 2.373 0 N-CA-C 119.001 2.963 . . . . 0.0 119.001 113.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -56.98 -63.28 0.17 Allowed 'Trans proline' 0 CA--C 1.578 2.682 0 CA-C-N 123.925 2.438 . . . . 0.0 114.499 158.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.3 t . . . . . 0 N--CA 1.487 1.376 0 C-N-CA 123.829 0.851 . . . . 0.0 112.314 170.208 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? . . . . . 0 CA--C 1.57 1.736 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' LEU . . . . . . . . . . . . . 1.7 pp -63.08 170.82 2.35 Favored Pre-proline 0 CA--C 1.586 2.364 0 N-CA-C 117.351 2.352 . . . . 0.0 117.351 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . 0.25 33.6 Cg_exo -68.1 155.6 68.93 Favored 'Trans proline' 0 CA--C 1.593 3.44 0 N-CA-C 122.45 3.981 . . . . 0.0 122.45 -172.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -73.41 135.73 22.79 Favored 'Trans proline' 0 CA--C 1.563 1.975 0 C-N-CA 123.311 2.674 . . . . 0.0 112.694 175.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' GLY . . . . . . . . . . . . . . . 83.06 32.15 26.91 Favored Glycine 0 N--CA 1.489 2.228 0 N-CA-C 117.62 1.808 . . . . 0.0 117.62 -161.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . 0.261 17.1 m95 -116.68 162.44 17.65 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 120.589 2.195 . . . . 0.0 114.521 170.209 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -145.95 -148.1 0.24 Allowed 'General case' 0 CA--C 1.573 1.855 0 CA-C-O 121.966 0.889 . . . . 0.0 111.671 150.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -149.49 118.93 6.88 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.227 -1.546 . . . . 0.0 110.415 -163.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 16.5 mtt-85 -137.93 115.48 11.26 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.098 -1.626 . . . . 0.0 114.449 -161.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' MET . . . . . 0.407 ' HA ' ' O ' ' B' ' 17' ' ' VAL . 0.0 OUTLIER -101.11 114.04 27.62 Favored 'General case' 0 CA--C 1.554 1.119 0 N-CA-C 114.973 1.472 . . . . 0.0 114.973 -152.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 78.9 p 46.7 87.33 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.383 0 N-CA-C 119.998 3.332 . . . . 0.0 119.998 169.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . . . . . . . . 0.256 0.0 OUTLIER -56.03 -40.49 73.53 Favored 'General case' 0 N--CA 1.502 2.138 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 173.005 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' SER . . . . . . . . . . . . . 84.9 p -160.6 55.49 0.32 Allowed 'General case' 0 CA--C 1.576 1.974 0 C-N-CA 124.283 1.033 . . . . 0.0 111.584 168.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -164.82 -114.34 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 O-C-N 120.399 -1.438 . . . . 0.0 109.809 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -161.33 26.69 0.27 Allowed Glycine 0 N--CA 1.498 2.816 0 N-CA-C 116.558 1.383 . . . . 0.0 116.558 172.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -138.47 170.7 15.56 Favored 'General case' 0 CA--C 1.571 1.781 0 C-N-CA 125.019 1.327 . . . . 0.0 109.408 171.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' B' ' 10' ' ' MET 0.809 0.3 OUTLIER 93.31 131.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.86 0 O-C-N 120.774 -1.204 . . . . 0.0 111.723 -156.543 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . 0.339 1.4 p90 -177.83 8.73 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.477 0 C-N-CA 126.084 1.754 . . . . 0.0 114.606 -167.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -136.12 137.44 41.01 Favored 'General case' 0 N--CA 1.507 2.421 0 O-C-N 119.185 -2.197 . . . . 0.0 109.373 174.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -140.12 130.28 25.04 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 119.509 -1.994 . . . . 0.0 112.922 175.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.63 129.7 39.81 Favored 'General case' 0 CA--C 1.573 1.834 0 O-C-N 120.091 -1.631 . . . . 0.0 111.149 171.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' HIS . . . . . . . . . . . . . 36.4 m-70 -82.69 -53.56 5.82 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 114.748 1.388 . . . . 0.0 114.748 175.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ILE . . . . . . . . . . . . . 31.1 pt -62.94 -50.0 81.38 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 N-CA-C 115.505 1.668 . . . . 0.0 115.505 -179.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' THR . . . . . . . . . . . . . 94.5 m -58.17 -42.3 85.71 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 158.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ASN . . . . . . . . . . . . 0.314 11.5 t-20 77.5 73.02 0.06 Allowed 'General case' 0 CA--C 1.565 1.546 0 C-N-CA 125.763 1.625 . . . . 0.0 109.433 179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -152.0 134.56 15.38 Favored 'General case' 0 N--CA 1.486 1.363 0 O-C-N 121.535 -0.728 . . . . 0.0 111.811 -169.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' SER . . . . . . . . . . . . . 92.5 p -86.62 131.7 34.09 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.023 -1.048 . . . . 0.0 112.555 161.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . 0.274 1.3 pt20 -133.68 161.72 33.89 Favored 'General case' 0 CA--C 1.566 1.571 0 CA-C-O 122.573 1.177 . . . . 0.0 112.682 167.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' TRP . . . . . . . . . . . . 0.276 0.1 OUTLIER -108.87 19.61 19.42 Favored 'General case' 0 N--CA 1.499 1.988 0 N-CA-C 115.164 1.542 . . . . 0.0 115.164 170.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -157.56 38.89 0.28 Allowed 'General case' 0 CA--C 1.567 1.607 0 N-CA-C 119.869 3.285 . . . . 0.0 119.869 -171.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . 0.51 0.0 OUTLIER 54.28 142.67 0.03 OUTLIER Pre-proline 0 CA--C 1.59 2.493 0 N-CA-C 121.393 3.849 . . . . 0.0 121.393 166.379 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -69.45 3.24 2.74 Favored 'Trans proline' 0 CA--C 1.578 2.684 0 N-CA-C 118.36 2.408 . . . . 0.0 118.36 179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . 0.358 8.6 m 78.07 -47.72 0.46 Allowed 'General case' 0 N--CA 1.501 2.083 0 N-CA-C 116.991 2.219 . . . . 0.0 116.991 -172.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' GLY . . . . . . . . . . . . . . . -69.9 80.28 0.35 Allowed Glycine 0 N--CA 1.5 2.957 0 CA-C-N 120.411 1.46 . . . . 0.0 116.014 176.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -132.04 -44.66 0.95 Allowed 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 114.144 1.164 . . . . 0.0 114.144 -166.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 11.1 t -73.61 -10.55 59.82 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 119.002 2.964 . . . . 0.0 119.002 179.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' SER . . . . . . . . . . . . . 44.4 p -71.14 114.81 9.58 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 121.241 1.837 . . . . 0.0 111.408 158.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' SER . . . . . . . . . . . . . 3.7 t -144.17 -83.3 0.15 Allowed 'General case' 0 CA--C 1.552 1.054 0 CA-C-N 114.906 -1.043 . . . . 0.0 111.081 -164.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 1.6 0 C-N-CA 118.04 -2.029 . . . . 0.0 110.101 -119.387 . . . . . . . . 0 0 . 1 stop_ save_