data_2rm0_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 2rm0 _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' W' W ' 6' ' ' SER . . . . . 0.421 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.7 t . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' W' W ' 7' ' ' GLU . . . . . 0.704 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 35.8 mt-10 71.8 77.81 0.16 Allowed 'General case' 0 C--N 1.322 -0.622 0 O-C-N 124.472 1.108 . . . . 0.0 108.721 -178.206 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 8' ' ' TRP . . . . . 0.714 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 27.4 m95 -124.5 111.55 15.83 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.897 -173.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 9' ' ' THR . . . . . 0.515 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 2.2 t -99.69 -174.4 2.7 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 122.413 1.101 . . . . 0.0 110.468 177.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 10' ' ' GLU . . . . . 0.515 ' N ' ' OG1' ' W' ' 9' ' ' THR . 16.7 mt-10 -110.99 122.28 47.48 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.846 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 11' ' ' TYR . . . . . 0.525 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 1.9 m-85 -128.83 115.59 18.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.407 0.623 . . . . 0.0 110.046 175.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -96.9 120.63 37.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.067 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 16.4 p -90.71 165.66 13.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.334 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -18.4 61.38 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -171.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' W' W ' 15' ' ' ASP . . . . . 0.436 ' OD2' ' HB2' ' W' ' 17' ' ' LYS . 6.3 p-10 -84.73 -3.19 58.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 110.954 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.39 17.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.881 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' W' W ' 17' ' ' LYS . . . . . 0.436 ' HB2' ' OD2' ' W' ' 15' ' ' ASP . 14.7 tppt? -97.86 130.21 44.78 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -177.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.7 94.06 9.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' W' W ' 19' ' ' TYR . . . . . 0.613 ' HD1' ' O ' ' W' ' 29' ' ' THR . 0.0 OUTLIER -108.11 157.58 18.15 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.748 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' W' W ' 20' ' ' TYR . . . . . 0.696 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 85.5 m-85 -107.98 145.55 33.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.556 0.693 . . . . 0.0 110.232 -173.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 21' ' ' TYR . . . . . 0.499 ' HB3' HG21 ' W' ' 9' ' ' THR . 40.8 t80 -117.53 101.71 8.59 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 22' ' ' ASN . . . . . 0.714 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.3 t-20 -56.92 113.83 1.84 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 113.602 -1.636 . . . . 0.0 110.434 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 23' ' ' ASN . . . . . 0.704 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 5.9 t30 -92.28 -7.28 48.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 24' ' ' ARG . . . . . 0.443 ' HB3' HD22 ' W' ' 22' ' ' ASN . 0.5 OUTLIER -54.89 -60.63 3.1 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.226 -176.369 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 10.1 p -132.24 20.73 4.42 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.393 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 65.1 81.92 0.2 Allowed 'General case' 0 CA--C 1.531 0.233 0 O-C-N 123.79 0.681 . . . . 0.0 110.265 -174.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 27' ' ' GLU . . . . . 0.493 ' HG3' ' N ' ' W' ' 28' ' ' SER . 9.9 tp10 -141.96 166.37 24.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.047 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 28' ' ' SER . . . . . 0.493 ' N ' ' HG3' ' W' ' 27' ' ' GLU . 0.3 OUTLIER -114.35 149.83 35.49 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 122.077 -0.389 . . . . 0.0 111.008 174.648 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' W' W ' 29' ' ' THR . . . . . 0.696 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 15.0 p -143.43 138.53 29.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 172.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 30' ' ' TRP . . . . . 0.618 ' CD1' HG23 ' P' ' 105' ' ' ILE . 90.4 m95 -70.21 -70.78 0.27 Allowed 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.682 178.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.0 -160.65 0.77 Allowed 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.88 -179.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -57.39 128.68 79.26 Favored Pre-proline 0 C--O 1.231 0.117 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' W' W ' 33' ' ' PRO . . . . . 0.534 ' HD2' ' HB3' ' W' ' 36' ' ' LEU . 74.3 Cg_exo -64.59 -178.82 0.76 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.51 3.474 . . . . 0.0 113.594 170.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -72.23 -52.29 17.11 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.426 -177.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -80.0 -23.48 41.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 111.372 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' W' W ' 36' ' ' LEU . . . . . 0.582 HD22 ' CD1' ' W' ' 8' ' ' TRP . 12.8 tp -84.87 101.45 12.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.564 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 46.9 mttp . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.692 -167.89 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo . . . . . 0 N--CA 1.481 0.783 0 N-CA-C 109.464 -1.014 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' P' P ' 102' ' ' PRO . . . . . 0.446 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 72.5 Cg_endo -77.99 148.66 25.05 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.51 1.473 . . . . 0.0 113.061 -177.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 103' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.6 Cg_exo -78.22 148.94 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.958 3.106 . . . . 0.0 111.543 171.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.12 148.63 34.09 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 167.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' P' P ' 105' ' ' ILE . . . . . 0.695 HG22 ' O ' ' P' ' 106' ' ' PRO . 2.0 mp -78.48 148.56 73.82 Favored Pre-proline 0 C--N 1.322 -0.592 0 C-N-CA 120.333 -0.547 . . . . 0.0 109.681 176.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 106' ' ' PRO . . . . . 0.695 ' O ' HG22 ' P' ' 105' ' ' ILE . 71.7 Cg_endo -78.16 148.69 24.57 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 121.825 1.683 . . . . 0.0 110.396 163.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 107' ' ' PRO . . . . . 0.442 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 5.7 Cg_exo -78.07 148.84 24.98 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.163 1.242 . . . . 0.0 111.878 177.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' P' P ' 108' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 2.8 Cg_exo . . . . . 0 N--CA 1.458 -0.587 0 C-N-CA 122.731 2.288 . . . . 0.0 111.083 171.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 6' ' ' SER . . . . . . . . . . . . . 21.3 t . . . . . 0 C--O 1.235 0.313 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 72.85 85.26 0.12 Allowed 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 124.637 1.21 . . . . 0.0 109.538 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 8' ' ' TRP . . . . . 0.626 ' CZ3' ' ND2' ' W' ' 22' ' ' ASN . 47.3 m95 -124.29 134.89 53.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 113.745 -1.57 . . . . 0.0 110.041 -176.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 9' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 1.5 t -121.32 -179.19 3.99 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 122.414 1.102 . . . . 0.0 110.702 174.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 10' ' ' GLU . . . . . 0.497 ' N ' ' OG1' ' W' ' 9' ' ' THR . 38.4 mt-10 -112.05 119.46 38.54 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 112.515 -2.13 . . . . 0.0 109.492 -178.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -123.73 88.59 2.94 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.817 0.817 . . . . 0.0 109.554 175.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -80.24 107.3 12.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.887 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 70.8 p -74.86 173.61 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.054 0.454 . . . . 0.0 111.78 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.5 -18.08 64.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.996 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.4 -23.09 62.7 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.883 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.18 29.93 10.77 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.668 -175.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 37.1 tptt -107.19 131.98 53.56 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 -176.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.2 m -87.41 97.97 11.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.701 0.286 . . . . 0.0 110.37 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 19' ' ' TYR . . . . . 0.56 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.2 OUTLIER -118.31 161.87 19.21 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.102 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' W' W ' 20' ' ' TYR . . . . . 0.671 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 52.8 m-85 -107.66 144.5 34.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.99 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 21' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -117.16 126.17 52.38 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 22' ' ' ASN . . . . . 0.796 ' ND2' ' H ' ' W' ' 24' ' ' ARG . 3.9 t-20 -91.17 120.62 32.26 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.024 -1.444 . . . . 0.0 111.396 -170.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -91.58 2.41 56.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.868 172.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 24' ' ' ARG . . . . . 0.796 ' H ' ' ND2' ' W' ' 22' ' ' ASN . 60.9 ttt180 -59.94 -68.3 0.3 Allowed 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.664 0.745 . . . . 0.0 110.573 -178.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 25' ' ' THR . . . . . 0.592 HG22 ' HG2' ' W' ' 24' ' ' ARG . 21.9 p -126.47 21.66 7.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.577 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 63.92 76.03 0.37 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.117 -173.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 27' ' ' GLU . . . . . 0.5 ' HG3' ' N ' ' W' ' 28' ' ' SER . 5.5 tp10 -127.76 159.0 36.13 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.457 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 28' ' ' SER . . . . . 0.623 ' HB3' HG21 ' P' ' 105' ' ' ILE . 0.1 OUTLIER -114.59 151.46 33.41 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 171.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' W' W ' 29' ' ' THR . . . . . 0.671 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 11.3 p -143.55 131.25 21.33 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 30' ' ' TRP . . . . . 0.58 ' CE2' ' HB ' ' P' ' 105' ' ' ILE . 94.7 m95 -69.92 -50.49 41.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 0.0 110.222 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -105.41 -167.97 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.001 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -77.81 140.38 62.95 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.448 -174.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 33' ' ' PRO . . . . . 0.865 ' HD2' HD23 ' W' ' 36' ' ' LEU . 54.0 Cg_exo -64.35 161.5 34.28 Favored 'Trans proline' 0 N--CA 1.474 0.364 0 C-N-CA 123.383 2.722 . . . . 0.0 112.231 170.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -95.82 -17.82 20.86 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.028 0.442 . . . . 0.0 110.568 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -80.93 -9.71 59.8 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.714 0.768 . . . . 0.0 109.038 170.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' W' W ' 36' ' ' LEU . . . . . 0.865 HD23 ' HD2' ' W' ' 33' ' ' PRO . 24.2 tp -101.88 113.25 26.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.978 174.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.436 -0.792 . . . . 0.0 110.42 -173.667 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo . . . . . 0 N--CA 1.477 0.512 0 N-CA-C 109.602 -0.961 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' P' P ' 102' ' ' PRO . . . . . 0.458 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.3 Cg_endo -78.02 148.94 25.21 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.393 2.062 . . . . 0.0 111.987 177.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 103' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.4 Cg_exo -78.12 148.57 24.58 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.01 177.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 104' ' ' LEU . . . . . 0.638 HD22 ' H ' ' P' ' 104' ' ' LEU . 2.4 pt? -77.91 148.79 34.39 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 173.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 105' ' ' ILE . . . . . 0.623 HG21 ' HB3' ' W' ' 28' ' ' SER . 2.0 mp -78.34 148.78 74.7 Favored Pre-proline 0 C--N 1.319 -0.738 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 170.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 106' ' ' PRO . . . . . 0.612 ' O ' HG22 ' P' ' 105' ' ' ILE . 72.4 Cg_endo -78.19 148.92 24.68 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 121.176 1.25 . . . . 0.0 110.477 163.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.38 149.15 24.29 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.334 2.023 . . . . 0.0 111.544 172.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo . . . . . 0 N--CA 1.46 -0.482 0 C-N-CA 121.877 1.718 . . . . 0.0 111.167 177.427 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' W' W ' 6' ' ' SER . . . . . 0.51 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 96.9 p . . . . . 0 N--CA 1.435 -1.2 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 73.68 77.79 0.13 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -172.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 8' ' ' TRP . . . . . 0.63 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 43.5 m95 -124.03 125.94 45.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.282 -174.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 9' ' ' THR . . . . . . . . . . . . . 9.9 t -115.98 -171.63 2.02 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.617 1.199 . . . . 0.0 110.513 173.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 10' ' ' GLU . . . . . 0.612 ' HB3' ' HE3' ' W' ' 12' ' ' LYS . 40.4 mt-10 -112.33 122.13 46.84 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.372 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -127.37 107.22 9.78 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.417 0.627 . . . . 0.0 110.396 176.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 12' ' ' LYS . . . . . 0.612 ' HE3' ' HB3' ' W' ' 10' ' ' GLU . 0.0 OUTLIER -100.61 118.39 36.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.327 -178.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.6 p -75.0 168.24 20.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.673 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.42 -23.76 66.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.307 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -85.14 -10.63 56.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.441 178.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.86 58.81 1.15 Allowed Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.007 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 17' ' ' LYS . . . . . 0.56 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.7 mmtm -119.14 144.0 46.89 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.9 m -99.34 95.71 7.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.275 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 19' ' ' TYR . . . . . 0.711 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.35 165.69 13.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.915 175.768 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' W' W ' 20' ' ' TYR . . . . . 0.606 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 42.2 m-85 -107.67 144.69 34.39 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.261 0.553 . . . . 0.0 109.822 -175.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 21' ' ' TYR . . . . . 0.435 ' HH ' HD11 ' W' ' 26' ' ' LEU . 41.6 t80 -117.3 99.34 6.95 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.337 1.065 . . . . 0.0 108.44 -176.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 22' ' ' ASN . . . . . 0.707 ' OD1' ' HB3' ' W' ' 24' ' ' ARG . 4.3 t30 -57.17 101.65 0.07 Allowed 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 112.737 -2.029 . . . . 0.0 110.944 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -84.31 -1.52 55.5 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 24' ' ' ARG . . . . . 0.707 ' HB3' ' OD1' ' W' ' 22' ' ' ASN . 19.7 ttp180 -56.36 -61.41 2.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.893 177.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 25' ' ' THR . . . . . 0.687 ' H ' ' ND2' ' W' ' 22' ' ' ASN . 5.2 p -132.4 19.35 4.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.612 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 26' ' ' LEU . . . . . 0.435 HD11 ' HH ' ' W' ' 21' ' ' TYR . 0.5 OUTLIER 63.96 81.82 0.2 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.527 0.68 . . . . 0.0 109.8 -173.268 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' W' W ' 27' ' ' GLU . . . . . 0.602 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.2 tp10 -142.3 165.64 26.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.215 -178.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 28' ' ' SER . . . . . 0.519 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 14.8 m -114.75 151.92 32.93 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.523 0.201 . . . . 0.0 111.535 173.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 29' ' ' THR . . . . . 0.606 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 10.5 p -143.84 137.02 27.65 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 172.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 30' ' ' TRP . . . . . 0.711 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 80.1 m95 -69.84 -57.99 4.41 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 121.774 -0.579 . . . . 0.0 110.459 176.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -105.17 -174.06 2.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.994 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 32' ' ' LYS . . . . . 0.461 ' HD3' ' OXT' ' W' ' 37' ' ' LYS . 60.3 mttp -52.74 142.46 33.06 Favored Pre-proline 0 C--O 1.238 0.493 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.751 -178.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 33' ' ' PRO . . . . . 0.479 ' HG2' HD23 ' W' ' 36' ' ' LEU . 46.1 Cg_exo -64.84 -165.79 0.08 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.013 3.142 . . . . 0.0 113.256 171.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -92.61 -40.76 10.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.569 -172.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.22 -28.3 14.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.025 178.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 36' ' ' LEU . . . . . 0.479 HD23 ' HG2' ' W' ' 33' ' ' PRO . 24.7 tp -77.25 84.91 3.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.405 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' W' W ' 37' ' ' LYS . . . . . 0.461 ' OXT' ' HD3' ' W' ' 32' ' ' LYS . 56.1 mttp . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.101 174.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo . . . . . 0 N--CA 1.479 0.653 0 N-CA-C 110.205 -0.729 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' P' P ' 102' ' ' PRO . . . . . 0.473 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.9 Cg_endo -77.82 148.74 25.62 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.44 2.093 . . . . 0.0 112.239 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 103' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 9.9 Cg_exo -77.69 148.87 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 123.422 2.748 . . . . 0.0 111.637 174.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 82.1 mt -78.28 148.98 33.64 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 105' ' ' ILE . . . . . 0.709 HG21 ' CD1' ' W' ' 30' ' ' TRP . 2.1 mp -77.87 148.97 76.6 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 120.251 -0.579 . . . . 0.0 109.513 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 106' ' ' PRO . . . . . 0.552 ' HD2' ' CG2' ' P' ' 105' ' ' ILE . 72.1 Cg_endo -78.13 148.6 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.698 1.599 . . . . 0.0 109.944 165.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.32 148.94 24.32 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.609 2.206 . . . . 0.0 112.872 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo . . . . . 0 N--CA 1.457 -0.618 0 C-N-CA 122.025 1.817 . . . . 0.0 109.617 166.016 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' W' W ' 6' ' ' SER . . . . . 0.562 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 52.8 m . . . . . 0 N--CA 1.442 -0.841 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 7' ' ' GLU . . . . . 0.647 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 39.6 mm-40 67.77 80.45 0.21 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -170.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 8' ' ' TRP . . . . . 0.802 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 25.2 m95 -124.61 111.24 15.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.716 -170.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 9' ' ' THR . . . . . 0.476 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 0.6 OUTLIER -99.91 172.39 7.26 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.812 1.291 . . . . 0.0 111.5 175.814 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' W' W ' 10' ' ' GLU . . . . . 0.476 ' N ' ' OG1' ' W' ' 9' ' ' THR . 8.4 pt-20 -108.57 119.89 40.83 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 112.012 -2.358 . . . . 0.0 110.225 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -124.48 105.34 9.32 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.527 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.13 115.15 25.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.575 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -79.83 170.24 16.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.736 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.78 -16.84 62.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.779 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -84.94 0.18 52.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.259 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.86 26.35 60.65 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.001 -0.619 . . . . 0.0 111.71 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -105.47 124.95 50.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 91.9 m -86.91 106.34 17.71 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 19' ' ' TYR . . . . . 0.626 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.7 OUTLIER -109.59 163.91 13.02 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.588 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' W' W ' 20' ' ' TYR . . . . . 0.619 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 32.8 m-85 -107.67 141.55 39.0 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.366 0.603 . . . . 0.0 109.868 -176.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 21' ' ' TYR . . . . . 0.452 ' HB3' HG22 ' W' ' 9' ' ' THR . 51.7 t80 -117.39 94.72 4.66 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -177.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 22' ' ' ASN . . . . . 0.802 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 2.4 t-20 -51.19 109.04 0.29 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.056 -1.883 . . . . 0.0 110.461 -178.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 23' ' ' ASN . . . . . 0.647 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 65.0 t30 -91.7 5.8 48.34 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 174.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -64.61 0.86 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.269 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -131.93 17.3 4.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 -178.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 26' ' ' LEU . . . . . 0.454 HD12 ' HA ' ' W' ' 26' ' ' LEU . 4.1 mm? 67.24 61.35 0.48 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 122.363 1.078 . . . . 0.0 110.919 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 27' ' ' GLU . . . . . 0.585 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 2.4 tt0 -112.99 160.79 17.75 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.622 -1.626 . . . . 0.0 109.465 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 28' ' ' SER . . . . . 0.515 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 34.4 m -114.45 147.4 39.34 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 122.05 -0.406 . . . . 0.0 111.404 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 29' ' ' THR . . . . . 0.619 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 3.2 p -143.45 137.21 28.43 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 30' ' ' TRP . . . . . 0.638 ' CD1' HG21 ' P' ' 105' ' ' ILE . 72.3 m95 -72.15 -61.88 1.63 Allowed 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.729 -0.607 . . . . 0.0 110.652 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 31' ' ' GLU . . . . . 0.509 ' OE1' ' HG2' ' W' ' 32' ' ' LYS . 3.0 pt-20 -105.63 -161.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 119.347 -0.941 . . . . 0.0 111.138 172.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 32' ' ' LYS . . . . . 0.509 ' HG2' ' OE1' ' W' ' 31' ' ' GLU . 9.8 ptpp? -61.42 139.54 94.86 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-O 121.983 0.897 . . . . 0.0 113.055 -167.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 33' ' ' PRO . . . . . 0.638 ' HD2' HD21 ' W' ' 36' ' ' LEU . 71.5 Cg_exo -64.53 -178.62 0.71 Allowed 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 124.41 3.407 . . . . 0.0 114.116 172.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -51.36 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.57 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -94.5 3.46 55.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.452 -172.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' W' W ' 36' ' ' LEU . . . . . 0.638 HD21 ' HD2' ' W' ' 33' ' ' PRO . 6.5 tp -87.63 95.19 9.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.68 0.753 . . . . 0.0 109.775 177.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 pttm . . . . . 0 C--O 1.244 0.783 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.726 179.962 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo . . . . . 0 N--CA 1.481 0.737 0 N-CA-C 109.992 -0.811 . . . . 0.0 109.992 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' P' P ' 102' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.51 148.99 23.79 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.38 2.053 . . . . 0.0 111.98 -177.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 103' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.1 Cg_exo -78.12 148.51 24.54 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.852 2.368 . . . . 0.0 112.379 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.7 148.76 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 169.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' P' P ' 105' ' ' ILE . . . . . 0.652 HG23 ' O ' ' P' ' 106' ' ' PRO . 2.0 mp -77.88 148.97 76.53 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 106' ' ' PRO . . . . . 0.652 ' O ' HG23 ' P' ' 105' ' ' ILE . 73.2 Cg_endo -78.34 148.81 24.13 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 121.614 1.542 . . . . 0.0 109.614 166.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 107' ' ' PRO . . . . . 0.466 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 73.7 Cg_endo -78.39 149.12 24.25 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.332 1.355 . . . . 0.0 113.14 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' P' P ' 108' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 3.8 Cg_exo . . . . . 0 N--CA 1.463 -0.281 0 C-N-CA 123.055 2.503 . . . . 0.0 111.601 172.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 6' ' ' SER . . . . . 0.539 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 33.1 t . . . . . 0 CA--C 1.51 -0.561 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 7' ' ' GLU . . . . . 0.521 ' OE1' ' HD2' ' W' ' 24' ' ' ARG . 27.7 mt-10 63.0 79.89 0.25 Allowed 'General case' 0 N--CA 1.444 -0.725 0 CA-C-O 122.173 0.987 . . . . 0.0 108.808 -176.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 8' ' ' TRP . . . . . 0.656 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 36.0 m95 -124.08 124.73 43.17 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.833 -172.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 9' ' ' THR . . . . . 0.666 HG22 ' HB3' ' W' ' 21' ' ' TYR . 0.2 OUTLIER -112.43 176.84 4.85 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-O 122.117 0.961 . . . . 0.0 111.13 174.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' W' W ' 10' ' ' GLU . . . . . 0.487 ' N ' ' OG1' ' W' ' 9' ' ' THR . 43.3 mt-10 -111.95 118.9 36.76 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.822 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -123.96 119.12 28.66 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.837 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 12' ' ' LYS . . . . . 0.524 ' H ' ' HD2' ' W' ' 12' ' ' LYS . 0.0 OUTLIER -104.18 123.68 47.74 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.766 176.86 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 10.8 p -82.21 177.0 9.03 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.0 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.87 -26.86 62.67 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -175.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.83 -28.16 55.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.499 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.78 29.27 5.34 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.299 -0.721 . . . . 0.0 111.299 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 17' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 40.9 mmtm -96.74 123.34 40.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.468 -0.366 . . . . 0.0 110.402 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 51.9 m -86.53 106.37 17.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.357 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 19' ' ' TYR . . . . . 0.719 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 2.5 p90 -117.98 169.62 9.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.037 0.446 . . . . 0.0 110.306 175.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 20' ' ' TYR . . . . . 0.573 ' HB2' HG21 ' W' ' 29' ' ' THR . 34.9 m-85 -107.8 139.42 42.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.927 -177.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 21' ' ' TYR . . . . . 0.666 ' HB3' HG22 ' W' ' 9' ' ' THR . 58.6 t80 -116.98 99.12 6.86 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 -175.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 22' ' ' ASN . . . . . 0.656 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.9 t-20 -56.62 108.87 0.54 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.27 -177.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.97 4.44 50.08 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 24' ' ' ARG . . . . . 0.596 ' HB3' HD22 ' W' ' 22' ' ' ASN . 23.6 tpt180 -63.75 -63.67 1.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.697 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 16.6 p -130.44 20.84 5.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.267 177.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 26' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' W' ' 26' ' ' LEU . 0.3 OUTLIER 67.1 85.36 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.279 -175.813 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' W' W ' 27' ' ' GLU . . . . . 0.518 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 7.0 tp10 -142.17 160.29 40.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.172 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 28' ' ' SER . . . . . 0.528 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 6.3 m -114.54 140.11 49.03 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.261 -0.274 . . . . 0.0 110.718 172.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 29' ' ' THR . . . . . 0.573 HG21 ' HB2' ' W' ' 20' ' ' TYR . 1.7 t -144.23 136.37 26.4 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.521 176.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 30' ' ' TRP . . . . . 0.719 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 89.9 m95 -69.88 -70.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.704 0.288 . . . . 0.0 110.822 -174.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mp0 -86.94 -177.15 5.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.27 0.557 . . . . 0.0 111.054 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 32' ' ' LYS . . . . . 0.467 ' HD2' ' HB2' ' W' ' 37' ' ' LYS . 25.3 pttm -69.62 147.39 96.55 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.678 -174.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 33' ' ' PRO . . . . . 0.623 ' HD2' HD23 ' W' ' 36' ' ' LEU . 53.4 Cg_exo -64.71 163.94 25.87 Favored 'Trans proline' 0 C--N 1.336 -0.113 0 C-N-CA 123.573 2.848 . . . . 0.0 113.003 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -71.31 -27.66 63.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.147 -175.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.09 -20.52 21.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.455 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 36' ' ' LEU . . . . . 0.623 HD23 ' HD2' ' W' ' 33' ' ' PRO . 9.7 tp -97.1 101.65 13.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.811 -173.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' W' W ' 37' ' ' LYS . . . . . 0.467 ' HB2' ' HD2' ' W' ' 32' ' ' LYS . 27.9 mtpp . . . . . 0 C--O 1.245 0.828 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.591 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo . . . . . 0 N--CA 1.478 0.604 0 N-CA-C 111.072 -0.396 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' P' P ' 102' ' ' PRO . . . . . 0.401 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.3 Cg_exo -77.71 148.65 25.87 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.946 2.431 . . . . 0.0 111.06 176.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 103' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.63 148.56 26.04 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.377 2.052 . . . . 0.0 112.661 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.29 149.19 33.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.926 172.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' P' P ' 105' ' ' ILE . . . . . 0.707 HG21 ' CD1' ' W' ' 30' ' ' TRP . 1.8 mp -78.19 148.62 74.93 Favored Pre-proline 0 C--N 1.32 -0.684 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.298 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 106' ' ' PRO . . . . . 0.608 ' O ' HG23 ' P' ' 105' ' ' ILE . 73.0 Cg_endo -78.15 148.68 24.59 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.678 2.252 . . . . 0.0 111.126 164.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 107' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' P' ' 106' ' ' PRO . 4.4 Cg_exo -78.28 148.9 24.4 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.118 1.879 . . . . 0.0 111.093 171.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo . . . . . 0 N--CA 1.458 -0.614 0 C-N-CA 121.503 1.469 . . . . 0.0 111.383 176.832 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' W' W ' 6' ' ' SER . . . . . 0.523 ' O ' ' HB2' ' W' ' 7' ' ' GLU . 18.5 t . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 7' ' ' GLU . . . . . 0.964 ' HB3' ' HB2' ' W' ' 23' ' ' ASN . 0.9 OUTLIER 74.51 79.04 0.11 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.381 1.051 . . . . 0.0 108.423 -171.64 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' W' W ' 8' ' ' TRP . . . . . 0.648 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 20.7 m95 -124.73 112.26 16.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 109.834 -172.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 9' ' ' THR . . . . . 0.919 HG22 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -100.01 167.41 10.51 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 122.331 1.062 . . . . 0.0 111.673 176.013 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' W' W ' 10' ' ' GLU . . . . . 0.404 ' N ' ' OG1' ' W' ' 9' ' ' THR . 8.3 pt-20 -102.94 112.33 25.1 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 112.594 -2.094 . . . . 0.0 110.359 -176.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 11' ' ' TYR . . . . . 0.438 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 3.4 m-85 -124.01 110.15 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.009 -175.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -99.22 123.34 43.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.702 175.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 69.0 p -81.83 170.8 15.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.477 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -13.02 62.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -80.69 -16.7 53.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.654 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.8 13.72 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.06 -0.591 . . . . 0.0 111.744 -176.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -104.35 124.24 48.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.544 0.211 . . . . 0.0 110.805 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 87.7 m -87.04 103.57 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.72 175.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 19' ' ' TYR . . . . . 0.686 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 1.1 p90 -118.17 166.14 12.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.202 0.525 . . . . 0.0 110.653 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 20' ' ' TYR . . . . . 0.694 ' HB2' HG23 ' W' ' 29' ' ' THR . 35.8 m-85 -107.92 144.61 34.94 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.313 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 21' ' ' TYR . . . . . 0.919 ' HB3' HG22 ' W' ' 9' ' ' THR . 50.9 t80 -117.1 114.04 23.15 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 22' ' ' ASN . . . . . 0.74 ' OD1' ' HB3' ' W' ' 24' ' ' ARG . 4.8 t30 -74.68 101.95 4.44 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.767 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 23' ' ' ASN . . . . . 0.964 ' HB2' ' HB3' ' W' ' 7' ' ' GLU . 79.1 m-20 -80.81 -10.03 59.76 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 24' ' ' ARG . . . . . 0.74 ' HB3' ' OD1' ' W' ' 22' ' ' ASN . 15.4 ttp180 -49.9 -59.51 3.79 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.125 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 25' ' ' THR . . . . . 0.677 ' H ' ' ND2' ' W' ' 22' ' ' ASN . 8.8 p -132.12 17.66 4.55 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.2 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 62.79 81.86 0.19 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.005 -172.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 27' ' ' GLU . . . . . 0.628 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.4 tp10 -142.03 167.53 21.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.54 -178.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 28' ' ' SER . . . . . 0.574 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -114.58 143.48 44.93 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 172.186 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' W' W ' 29' ' ' THR . . . . . 0.694 HG23 ' HB2' ' W' ' 20' ' ' TYR . 1.5 t -144.05 137.08 27.37 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 173.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 30' ' ' TRP . . . . . 0.686 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 92.4 m95 -69.89 -82.14 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.661 0.267 . . . . 0.0 111.464 -174.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -105.24 -155.79 0.55 Allowed 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.897 -172.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -53.12 115.82 8.21 Favored Pre-proline 0 N--CA 1.464 0.243 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -168.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 33' ' ' PRO . . . . . 0.47 ' HB2' ' HB3' ' W' ' 36' ' ' LEU . 36.5 Cg_exo -65.09 148.31 89.2 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 123.203 2.602 . . . . 0.0 111.286 169.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.63 -37.93 68.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.452 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -94.84 24.82 4.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.001 0.429 . . . . 0.0 111.174 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' W' W ' 36' ' ' LEU . . . . . 0.561 HD23 ' CD1' ' W' ' 8' ' ' TRP . 34.8 tp -156.45 43.2 0.39 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.011 0.91 . . . . 0.0 108.811 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' W' W ' 37' ' ' LYS . . . . . 0.562 ' HZ1' ' HB3' ' W' ' 37' ' ' LYS . 8.2 mtpm? . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.597 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 101' ' ' PRO . . . . . 0.476 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 1.7 Cg_endo . . . . . 0 N--CA 1.474 0.377 0 N-CA-C 110.187 -0.736 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 102' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' P' ' 101' ' ' PRO . 4.9 Cg_exo -78.06 148.95 25.09 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.928 2.419 . . . . 0.0 111.99 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 103' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.94 148.68 25.23 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.545 2.163 . . . . 0.0 111.629 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 104' ' ' LEU . . . . . 0.44 ' O ' HD12 ' P' ' 104' ' ' LEU . 3.5 pp -78.05 148.91 34.08 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.367 173.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 105' ' ' ILE . . . . . 0.63 HD12 ' H ' ' P' ' 105' ' ' ILE . 1.7 mp -78.45 148.81 74.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 106' ' ' PRO . . . . . 0.603 ' O ' HG23 ' P' ' 105' ' ' ILE . 60.2 Cg_endo -78.14 148.88 24.79 Favored 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.07 1.846 . . . . 0.0 110.682 162.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.95 149.14 25.6 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.625 1.55 . . . . 0.0 112.111 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.458 -0.597 0 C-N-CA 122.298 1.998 . . . . 0.0 112.106 -178.541 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' W' W ' 6' ' ' SER . . . . . 0.771 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.1 t . . . . . 0 N--CA 1.446 -0.658 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 61.77 77.73 0.32 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -168.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 8' ' ' TRP . . . . . 0.79 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 45.1 m95 -124.19 124.74 43.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.464 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 9' ' ' THR . . . . . 0.664 HG21 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -108.62 167.99 9.65 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-O 122.651 1.215 . . . . 0.0 111.89 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' W' W ' 10' ' ' GLU . . . . . 0.438 ' N ' ' OG1' ' W' ' 9' ' ' THR . 0.7 OUTLIER -106.54 115.99 31.16 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 111.838 -2.437 . . . . 0.0 110.455 -177.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -124.08 116.03 22.12 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.537 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 12' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' W' ' 17' ' ' LYS . 48.5 mtmt -103.69 113.24 26.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 77.2 p -79.92 173.98 12.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.161 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.88 -6.0 38.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.543 . . . . 0.0 111.102 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -84.99 -3.66 58.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.766 178.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.8 28.24 55.09 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 17' ' ' LYS . . . . . 0.432 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.3 mmtm -105.94 126.44 52.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.761 -175.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 95.8 m -88.3 101.84 14.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.041 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 19' ' ' TYR . . . . . 0.631 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.5 OUTLIER -115.64 163.52 15.68 Favored 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.377 178.406 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' W' W ' 20' ' ' TYR . . . . . 0.621 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 26.9 m-85 -107.81 143.11 36.85 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 121.454 0.645 . . . . 0.0 109.763 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 21' ' ' TYR . . . . . 0.664 ' HB3' HG21 ' W' ' 9' ' ' THR . 58.1 t80 -117.24 100.94 8.04 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 22' ' ' ASN . . . . . 0.79 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 3.8 t-20 -55.28 111.92 0.98 Allowed 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.52 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -98.52 5.02 48.27 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -61.33 -65.51 0.68 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.16 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 25' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' W' ' 26' ' ' LEU . 8.8 t -132.16 18.18 4.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.089 177.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 26' ' ' LEU . . . . . 0.422 ' HB2' ' O ' ' W' ' 25' ' ' THR . 4.3 mm? 71.06 85.04 0.13 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.221 -177.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 27' ' ' GLU . . . . . 0.515 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 1.6 tt0 -141.66 161.24 38.41 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.224 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 28' ' ' SER . . . . . 0.44 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 31.2 m -114.4 146.41 40.62 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 121.836 -0.54 . . . . 0.0 111.017 174.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 29' ' ' THR . . . . . 0.621 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 4.3 p -143.35 134.34 25.55 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 30' ' ' TRP . . . . . 0.645 ' CD1' HG22 ' P' ' 105' ' ' ILE . 80.6 m95 -69.76 -64.69 0.83 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.577 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -105.37 -164.4 1.03 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 32' ' ' LYS . . . . . 0.864 ' HD3' ' HA ' ' W' ' 37' ' ' LYS . 56.6 mttp -52.91 132.61 48.74 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 33' ' ' PRO . . . . . 0.526 ' HG2' HD23 ' W' ' 36' ' ' LEU . 35.8 Cg_exo -65.33 -159.78 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.497 3.464 . . . . 0.0 113.916 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -78.69 -68.04 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.178 -173.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -85.0 -8.55 58.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.176 0.512 . . . . 0.0 110.865 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' W' W ' 36' ' ' LEU . . . . . 0.526 HD23 ' HG2' ' W' ' 33' ' ' PRO . 38.0 tp -98.79 98.71 9.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.871 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' W' W ' 37' ' ' LYS . . . . . 0.864 ' HA ' ' HD3' ' W' ' 32' ' ' LYS . 62.6 pttt . . . . . 0 C--O 1.246 0.88 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.202 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.476 0.485 0 N-CA-C 110.092 -0.772 . . . . 0.0 110.092 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' P' P ' 102' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.27 149.14 24.61 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.63 2.22 . . . . 0.0 112.382 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 103' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.7 Cg_exo -78.0 148.87 25.21 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.244 2.629 . . . . 0.0 111.277 174.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 86.3 mt -78.09 149.09 33.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.016 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' P' P ' 105' ' ' ILE . . . . . 0.645 HG22 ' CD1' ' W' ' 30' ' ' TRP . 1.5 mp -78.52 148.55 73.68 Favored Pre-proline 0 C--N 1.326 -0.431 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 106' ' ' PRO . . . . . 0.626 ' O ' HG21 ' P' ' 105' ' ' ILE . 72.0 Cg_endo -77.78 148.59 25.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.927 1.752 . . . . 0.0 110.078 164.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 107' ' ' PRO . . . . . 0.472 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 72.7 Cg_endo -78.25 148.9 24.49 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.644 1.563 . . . . 0.0 112.468 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' P' P ' 108' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 5.2 Cg_exo . . . . . 0 N--CA 1.459 -0.519 0 C-N-CA 122.894 2.396 . . . . 0.0 111.342 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 6' ' ' SER . . . . . 0.445 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 9.3 t . . . . . 0 N--CA 1.45 -0.447 0 CA-C-O 121.042 0.449 . . . . 0.0 110.883 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 68.6 83.91 0.16 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.422 1.106 . . . . 0.0 109.314 -169.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 8' ' ' TRP . . . . . 0.73 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 49.0 m95 -124.94 114.87 19.73 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.729 -1.578 . . . . 0.0 108.662 -175.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 9' ' ' THR . . . . . 0.602 HG21 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -99.93 173.58 6.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.94 0.876 . . . . 0.0 112.056 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' W' W ' 10' ' ' GLU . . . . . 0.454 ' N ' ' OG1' ' W' ' 9' ' ' THR . 37.9 mt-10 -106.84 117.04 33.0 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 113.786 -1.552 . . . . 0.0 110.111 -176.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -127.02 106.69 9.45 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.686 -179.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -90.15 113.4 25.16 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.921 175.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.9 p -75.37 161.47 29.23 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.29 -19.8 64.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -65.67 -37.99 88.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.003 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.17 36.68 1.45 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.806 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -119.48 135.31 54.82 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 37.4 m -86.9 101.67 13.62 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 19' ' ' TYR . . . . . 0.734 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.15 162.41 18.27 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.615 178.279 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' W' W ' 20' ' ' TYR . . . . . 0.789 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 54.1 m-85 -107.71 150.62 26.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.209 -175.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 21' ' ' TYR . . . . . 0.602 ' HB3' HG21 ' W' ' 9' ' ' THR . 48.3 t80 -117.31 96.38 5.39 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.074 0.94 . . . . 0.0 108.49 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 22' ' ' ASN . . . . . 0.749 ' OD1' ' HB2' ' W' ' 24' ' ' ARG . 2.0 t30 -55.01 120.2 6.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.027 -1.897 . . . . 0.0 111.198 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -89.45 -12.79 39.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 24' ' ' ARG . . . . . 0.749 ' HB2' ' OD1' ' W' ' 22' ' ' ASN . 33.3 mtp180 -45.92 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 25' ' ' THR . . . . . 0.581 ' H ' HD22 ' W' ' 22' ' ' ASN . 14.9 t -110.98 25.16 12.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.118 175.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 26' ' ' LEU . . . . . 0.574 HD11 ' HH ' ' W' ' 21' ' ' TYR . 0.6 OUTLIER 63.8 86.69 0.12 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.171 -173.881 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' W' W ' 27' ' ' GLU . . . . . 0.585 ' N ' HD21 ' W' ' 22' ' ' ASN . 8.4 tp10 -142.26 165.1 28.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.46 -174.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 28' ' ' SER . . . . . 0.561 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 4.3 m -114.53 152.46 31.7 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.622 171.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 29' ' ' THR . . . . . 0.789 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 45.7 p -143.9 135.11 25.67 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 30' ' ' TRP . . . . . 0.734 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 77.7 m95 -69.81 -65.86 0.66 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 118.293 0.497 . . . . 0.0 110.821 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -105.33 -175.52 2.82 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.959 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.74 128.9 92.48 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.636 -174.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 33' ' ' PRO . . . . . 0.487 ' HD2' ' CD1' ' W' ' 36' ' ' LEU . 50.2 Cg_exo -64.82 153.85 75.83 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.706 2.937 . . . . 0.0 112.509 171.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -63.83 -30.94 71.98 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.264 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -85.8 6.95 25.75 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.425 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' W' W ' 36' ' ' LEU . . . . . 0.667 ' HG ' ' CD1' ' W' ' 8' ' ' TRP . 1.0 OUTLIER -103.68 110.96 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' W' W ' 37' ' ' LYS . . . . . 0.409 ' H ' ' HG3' ' W' ' 37' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.281 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.479 0.664 0 N-CA-C 110.535 -0.602 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' P' P ' 102' ' ' PRO . . . . . 0.412 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 6.0 Cg_exo -78.31 149.07 24.43 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.964 2.443 . . . . 0.0 111.249 173.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 103' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.0 Cg_exo -77.87 148.83 25.57 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.21 1.94 . . . . 0.0 111.57 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 56.1 tp -78.08 148.77 34.09 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' P' P ' 105' ' ' ILE . . . . . 0.625 HG22 ' CD1' ' W' ' 30' ' ' TRP . 1.1 mp -78.31 148.95 75.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.515 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 106' ' ' PRO . . . . . 0.561 ' CD ' ' HB2' ' W' ' 28' ' ' SER . 73.0 Cg_endo -78.18 148.86 24.65 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.195 2.597 . . . . 0.0 109.663 160.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -77.98 148.76 25.17 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.021 1.148 . . . . 0.0 111.535 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 C--N 1.345 0.387 0 C-N-CA 122.461 2.107 . . . . 0.0 112.717 179.7 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.13 145.41 53.38 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.899 0.38 . . . . 0.0 110.393 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 7.0 p -86.61 101.97 13.74 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.109 0.481 . . . . 0.0 110.07 177.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.28 145.44 55.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.813 -174.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 4.5 m -82.62 116.52 26.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.297 0.57 . . . . 0.0 110.546 175.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 6' ' ' SER . . . . . 0.421 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.7 t -169.9 -148.2 0.06 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.201 -0.908 . . . . 0.0 108.71 -175.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 7' ' ' GLU . . . . . 0.704 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 35.8 mt-10 71.8 77.81 0.16 Allowed 'General case' 0 C--N 1.322 -0.622 0 O-C-N 124.472 1.108 . . . . 0.0 108.721 -178.206 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 8' ' ' TRP . . . . . 0.714 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 27.4 m95 -124.5 111.55 15.83 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.897 -173.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 9' ' ' THR . . . . . 0.515 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 2.2 t -99.69 -174.4 2.7 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 122.413 1.101 . . . . 0.0 110.468 177.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 10' ' ' GLU . . . . . 0.515 ' N ' ' OG1' ' W' ' 9' ' ' THR . 16.7 mt-10 -110.99 122.28 47.48 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.846 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 11' ' ' TYR . . . . . 0.525 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 1.9 m-85 -128.83 115.59 18.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.407 0.623 . . . . 0.0 110.046 175.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -96.9 120.63 37.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.067 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 16.4 p -90.71 165.66 13.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.334 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -18.4 61.38 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -171.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 15' ' ' ASP . . . . . 0.436 ' OD2' ' HB2' ' W' ' 17' ' ' LYS . 6.3 p-10 -84.73 -3.19 58.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 110.954 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.39 17.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.881 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 17' ' ' LYS . . . . . 0.436 ' HB2' ' OD2' ' W' ' 15' ' ' ASP . 14.7 tppt? -97.86 130.21 44.78 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -177.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.7 94.06 9.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 19' ' ' TYR . . . . . 0.613 ' HD1' ' O ' ' W' ' 29' ' ' THR . 0.0 OUTLIER -108.11 157.58 18.15 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.748 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' W' W ' 20' ' ' TYR . . . . . 0.696 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 85.5 m-85 -107.98 145.55 33.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.556 0.693 . . . . 0.0 110.232 -173.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 21' ' ' TYR . . . . . 0.499 ' HB3' HG21 ' W' ' 9' ' ' THR . 40.8 t80 -117.53 101.71 8.59 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 22' ' ' ASN . . . . . 0.714 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.3 t-20 -56.92 113.83 1.84 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 113.602 -1.636 . . . . 0.0 110.434 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 23' ' ' ASN . . . . . 0.704 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 5.9 t30 -92.28 -7.28 48.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 24' ' ' ARG . . . . . 0.443 ' HB3' HD22 ' W' ' 22' ' ' ASN . 0.5 OUTLIER -54.89 -60.63 3.1 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.226 -176.369 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 10.1 p -132.24 20.73 4.42 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.393 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 65.1 81.92 0.2 Allowed 'General case' 0 CA--C 1.531 0.233 0 O-C-N 123.79 0.681 . . . . 0.0 110.265 -174.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 27' ' ' GLU . . . . . 0.493 ' HG3' ' N ' ' W' ' 28' ' ' SER . 9.9 tp10 -141.96 166.37 24.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.047 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 28' ' ' SER . . . . . 0.493 ' N ' ' HG3' ' W' ' 27' ' ' GLU . 0.3 OUTLIER -114.35 149.83 35.49 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 122.077 -0.389 . . . . 0.0 111.008 174.648 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' W' W ' 29' ' ' THR . . . . . 0.696 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 15.0 p -143.43 138.53 29.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 172.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 30' ' ' TRP . . . . . 0.618 ' CD1' HG23 ' P' ' 105' ' ' ILE . 90.4 m95 -70.21 -70.78 0.27 Allowed 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.682 178.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.0 -160.65 0.77 Allowed 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.88 -179.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -57.39 128.68 79.26 Favored Pre-proline 0 C--O 1.231 0.117 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 33' ' ' PRO . . . . . 0.534 ' HD2' ' HB3' ' W' ' 36' ' ' LEU . 74.3 Cg_exo -64.59 -178.82 0.76 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.51 3.474 . . . . 0.0 113.594 170.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -72.23 -52.29 17.11 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.426 -177.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -80.0 -23.48 41.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 111.372 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' W' W ' 36' ' ' LEU . . . . . 0.582 HD22 ' CD1' ' W' ' 8' ' ' TRP . 12.8 tp -84.87 101.45 12.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.564 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 46.9 mttp . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.692 -167.89 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo . . . . . 0 N--CA 1.481 0.783 0 N-CA-C 109.464 -1.014 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' P' P ' 102' ' ' PRO . . . . . 0.446 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 72.5 Cg_endo -77.99 148.66 25.05 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.51 1.473 . . . . 0.0 113.061 -177.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 103' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.6 Cg_exo -78.22 148.94 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.958 3.106 . . . . 0.0 111.543 171.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -78.12 148.63 34.09 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 167.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' P' P ' 105' ' ' ILE . . . . . 0.695 HG22 ' O ' ' P' ' 106' ' ' PRO . 2.0 mp -78.48 148.56 73.82 Favored Pre-proline 0 C--N 1.322 -0.592 0 C-N-CA 120.333 -0.547 . . . . 0.0 109.681 176.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.695 ' O ' HG22 ' P' ' 105' ' ' ILE . 71.7 Cg_endo -78.16 148.69 24.57 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 121.825 1.683 . . . . 0.0 110.396 163.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 107' ' ' PRO . . . . . 0.442 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 5.7 Cg_exo -78.07 148.84 24.98 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.163 1.242 . . . . 0.0 111.878 177.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 108' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 2.8 Cg_exo -78.1 149.06 25.1 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.731 2.288 . . . . 0.0 111.083 171.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 109' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo . . . . . 0 C--O 1.247 0.947 0 C-N-CA 122.705 2.27 . . . . 0.0 111.69 176.006 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.141 -0.384 . . . . 0.0 112.141 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.99 177.67 7.62 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.743 -0.269 . . . . 0.0 110.793 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 6.8 p -123.09 160.46 26.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.761 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -83.32 96.21 8.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.731 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 14.9 m -107.5 92.23 2.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.389 0.614 . . . . 0.0 110.899 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 6' ' ' SER . . . . . . . . . . . . . 21.3 t 178.12 -149.77 0.01 OUTLIER 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.391 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 72.85 85.26 0.12 Allowed 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 124.637 1.21 . . . . 0.0 109.538 -176.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 8' ' ' TRP . . . . . 0.626 ' CZ3' ' ND2' ' W' ' 22' ' ' ASN . 47.3 m95 -124.29 134.89 53.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 113.745 -1.57 . . . . 0.0 110.041 -176.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 9' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 1.5 t -121.32 -179.19 3.99 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 122.414 1.102 . . . . 0.0 110.702 174.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 10' ' ' GLU . . . . . 0.497 ' N ' ' OG1' ' W' ' 9' ' ' THR . 38.4 mt-10 -112.05 119.46 38.54 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 112.515 -2.13 . . . . 0.0 109.492 -178.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -123.73 88.59 2.94 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.817 0.817 . . . . 0.0 109.554 175.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -80.24 107.3 12.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.887 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 70.8 p -74.86 173.61 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.054 0.454 . . . . 0.0 111.78 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.5 -18.08 64.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.996 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.4 -23.09 62.7 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.883 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.18 29.93 10.77 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.668 -175.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 37.1 tptt -107.19 131.98 53.56 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 -176.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.2 m -87.41 97.97 11.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.701 0.286 . . . . 0.0 110.37 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 19' ' ' TYR . . . . . 0.56 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.2 OUTLIER -118.31 161.87 19.21 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.102 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' W' W ' 20' ' ' TYR . . . . . 0.671 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 52.8 m-85 -107.66 144.5 34.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.99 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 21' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -117.16 126.17 52.38 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 22' ' ' ASN . . . . . 0.796 ' ND2' ' H ' ' W' ' 24' ' ' ARG . 3.9 t-20 -91.17 120.62 32.26 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.024 -1.444 . . . . 0.0 111.396 -170.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -91.58 2.41 56.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.868 172.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 24' ' ' ARG . . . . . 0.796 ' H ' ' ND2' ' W' ' 22' ' ' ASN . 60.9 ttt180 -59.94 -68.3 0.3 Allowed 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.664 0.745 . . . . 0.0 110.573 -178.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 25' ' ' THR . . . . . 0.592 HG22 ' HG2' ' W' ' 24' ' ' ARG . 21.9 p -126.47 21.66 7.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.577 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 63.92 76.03 0.37 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.117 -173.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 27' ' ' GLU . . . . . 0.5 ' HG3' ' N ' ' W' ' 28' ' ' SER . 5.5 tp10 -127.76 159.0 36.13 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.457 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 28' ' ' SER . . . . . 0.623 ' HB3' HG21 ' P' ' 105' ' ' ILE . 0.1 OUTLIER -114.59 151.46 33.41 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 171.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' W' W ' 29' ' ' THR . . . . . 0.671 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 11.3 p -143.55 131.25 21.33 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 30' ' ' TRP . . . . . 0.58 ' CE2' ' HB ' ' P' ' 105' ' ' ILE . 94.7 m95 -69.92 -50.49 41.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 0.0 110.222 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -105.41 -167.97 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.001 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -77.81 140.38 62.95 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.448 -174.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 33' ' ' PRO . . . . . 0.865 ' HD2' HD23 ' W' ' 36' ' ' LEU . 54.0 Cg_exo -64.35 161.5 34.28 Favored 'Trans proline' 0 N--CA 1.474 0.364 0 C-N-CA 123.383 2.722 . . . . 0.0 112.231 170.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -95.82 -17.82 20.86 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.028 0.442 . . . . 0.0 110.568 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -80.93 -9.71 59.8 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.714 0.768 . . . . 0.0 109.038 170.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' W' W ' 36' ' ' LEU . . . . . 0.865 HD23 ' HD2' ' W' ' 33' ' ' PRO . 24.2 tp -101.88 113.25 26.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.978 174.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.436 -0.792 . . . . 0.0 110.42 -173.667 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo . . . . . 0 N--CA 1.477 0.512 0 N-CA-C 109.602 -0.961 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' P' P ' 102' ' ' PRO . . . . . 0.458 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.3 Cg_endo -78.02 148.94 25.21 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.393 2.062 . . . . 0.0 111.987 177.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 103' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.4 Cg_exo -78.12 148.57 24.58 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.01 177.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 104' ' ' LEU . . . . . 0.638 HD22 ' H ' ' P' ' 104' ' ' LEU . 2.4 pt? -77.91 148.79 34.39 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 173.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 105' ' ' ILE . . . . . 0.623 HG21 ' HB3' ' W' ' 28' ' ' SER . 2.0 mp -78.34 148.78 74.7 Favored Pre-proline 0 C--N 1.319 -0.738 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 170.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.612 ' O ' HG22 ' P' ' 105' ' ' ILE . 72.4 Cg_endo -78.19 148.92 24.68 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 121.176 1.25 . . . . 0.0 110.477 163.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.38 149.15 24.29 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.334 2.023 . . . . 0.0 111.544 172.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' P' P ' 108' ' ' PRO . . . . . 0.468 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 73.9 Cg_endo -77.75 148.95 26.04 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.877 1.718 . . . . 0.0 111.167 177.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 109' ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 6.1 Cg_exo . . . . . 0 C--O 1.246 0.893 0 C-N-CA 122.794 2.329 . . . . 0.0 112.032 -174.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.768 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . 70.43 93.52 0.08 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.486 0.66 . . . . 0.0 110.714 -177.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 31.4 p -86.34 22.71 1.75 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.304 -174.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.09 104.05 6.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.987 0.423 . . . . 0.0 111.534 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 59.3 t -99.48 90.64 2.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 6' ' ' SER . . . . . 0.51 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 96.9 p -169.57 -157.15 0.16 Allowed 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 -175.254 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 73.68 77.79 0.13 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -172.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 8' ' ' TRP . . . . . 0.63 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 43.5 m95 -124.03 125.94 45.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.282 -174.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 9' ' ' THR . . . . . . . . . . . . . 9.9 t -115.98 -171.63 2.02 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.617 1.199 . . . . 0.0 110.513 173.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 10' ' ' GLU . . . . . 0.612 ' HB3' ' HE3' ' W' ' 12' ' ' LYS . 40.4 mt-10 -112.33 122.13 46.84 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.372 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -127.37 107.22 9.78 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.417 0.627 . . . . 0.0 110.396 176.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 12' ' ' LYS . . . . . 0.612 ' HE3' ' HB3' ' W' ' 10' ' ' GLU . 0.0 OUTLIER -100.61 118.39 36.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.327 -178.799 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.6 p -75.0 168.24 20.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.673 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.42 -23.76 66.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.307 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -85.14 -10.63 56.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.441 178.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.86 58.81 1.15 Allowed Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.007 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 17' ' ' LYS . . . . . 0.56 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.7 mmtm -119.14 144.0 46.89 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.9 m -99.34 95.71 7.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.275 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 19' ' ' TYR . . . . . 0.711 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.35 165.69 13.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.915 175.768 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' W' W ' 20' ' ' TYR . . . . . 0.606 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 42.2 m-85 -107.67 144.69 34.39 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.261 0.553 . . . . 0.0 109.822 -175.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 21' ' ' TYR . . . . . 0.435 ' HH ' HD11 ' W' ' 26' ' ' LEU . 41.6 t80 -117.3 99.34 6.95 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.337 1.065 . . . . 0.0 108.44 -176.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 22' ' ' ASN . . . . . 0.707 ' OD1' ' HB3' ' W' ' 24' ' ' ARG . 4.3 t30 -57.17 101.65 0.07 Allowed 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 112.737 -2.029 . . . . 0.0 110.944 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -84.31 -1.52 55.5 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 24' ' ' ARG . . . . . 0.707 ' HB3' ' OD1' ' W' ' 22' ' ' ASN . 19.7 ttp180 -56.36 -61.41 2.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.893 177.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 25' ' ' THR . . . . . 0.687 ' H ' ' ND2' ' W' ' 22' ' ' ASN . 5.2 p -132.4 19.35 4.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.612 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 26' ' ' LEU . . . . . 0.435 HD11 ' HH ' ' W' ' 21' ' ' TYR . 0.5 OUTLIER 63.96 81.82 0.2 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.527 0.68 . . . . 0.0 109.8 -173.268 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' W' W ' 27' ' ' GLU . . . . . 0.602 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.2 tp10 -142.3 165.64 26.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.215 -178.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 28' ' ' SER . . . . . 0.519 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 14.8 m -114.75 151.92 32.93 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.523 0.201 . . . . 0.0 111.535 173.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 29' ' ' THR . . . . . 0.606 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 10.5 p -143.84 137.02 27.65 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 172.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 30' ' ' TRP . . . . . 0.711 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 80.1 m95 -69.84 -57.99 4.41 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 121.774 -0.579 . . . . 0.0 110.459 176.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -105.17 -174.06 2.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.994 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 32' ' ' LYS . . . . . 0.461 ' HD3' ' OXT' ' W' ' 37' ' ' LYS . 60.3 mttp -52.74 142.46 33.06 Favored Pre-proline 0 C--O 1.238 0.493 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.751 -178.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 33' ' ' PRO . . . . . 0.479 ' HG2' HD23 ' W' ' 36' ' ' LEU . 46.1 Cg_exo -64.84 -165.79 0.08 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.013 3.142 . . . . 0.0 113.256 171.89 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -92.61 -40.76 10.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.569 -172.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.22 -28.3 14.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.025 178.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 36' ' ' LEU . . . . . 0.479 HD23 ' HG2' ' W' ' 33' ' ' PRO . 24.7 tp -77.25 84.91 3.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.405 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' W' W ' 37' ' ' LYS . . . . . 0.461 ' OXT' ' HD3' ' W' ' 32' ' ' LYS . 56.1 mttp . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.101 174.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo . . . . . 0 N--CA 1.479 0.653 0 N-CA-C 110.205 -0.729 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' P' P ' 102' ' ' PRO . . . . . 0.473 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.9 Cg_endo -77.82 148.74 25.62 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.44 2.093 . . . . 0.0 112.239 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 103' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 9.9 Cg_exo -77.69 148.87 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 123.422 2.748 . . . . 0.0 111.637 174.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 82.1 mt -78.28 148.98 33.64 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 105' ' ' ILE . . . . . 0.709 HG21 ' CD1' ' W' ' 30' ' ' TRP . 2.1 mp -77.87 148.97 76.6 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 120.251 -0.579 . . . . 0.0 109.513 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.552 ' HD2' ' CG2' ' P' ' 105' ' ' ILE . 72.1 Cg_endo -78.13 148.6 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.698 1.599 . . . . 0.0 109.944 165.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.32 148.94 24.32 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.609 2.206 . . . . 0.0 112.872 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.95 148.79 25.29 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.025 1.817 . . . . 0.0 109.617 166.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' P' P ' 109' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo . . . . . 0 C--O 1.246 0.88 0 C-N-CA 122.4 2.067 . . . . 0.0 112.729 -178.164 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.937 -0.465 . . . . 0.0 111.937 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.27 -18.27 13.63 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.063 0.458 . . . . 0.0 109.942 173.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 14.7 t -155.86 165.83 35.3 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . 66.92 175.62 0.25 Allowed 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.723 0.639 . . . . 0.0 111.435 -176.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 5' ' ' VAL . . . . . 0.471 ' C ' ' HG ' ' W' ' 6' ' ' SER . 17.5 t 54.61 64.72 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.473 -178.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 6' ' ' SER . . . . . 0.562 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 52.8 m -169.12 -171.64 1.35 Allowed 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 -177.567 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 7' ' ' GLU . . . . . 0.647 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 39.6 mm-40 67.77 80.45 0.21 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -170.392 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 8' ' ' TRP . . . . . 0.802 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 25.2 m95 -124.61 111.24 15.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.716 -170.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 9' ' ' THR . . . . . 0.476 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 0.6 OUTLIER -99.91 172.39 7.26 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.812 1.291 . . . . 0.0 111.5 175.814 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' W' W ' 10' ' ' GLU . . . . . 0.476 ' N ' ' OG1' ' W' ' 9' ' ' THR . 8.4 pt-20 -108.57 119.89 40.83 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 112.012 -2.358 . . . . 0.0 110.225 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -124.48 105.34 9.32 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.527 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.13 115.15 25.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.575 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -79.83 170.24 16.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.736 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.78 -16.84 62.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.779 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -84.94 0.18 52.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.259 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.86 26.35 60.65 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.001 -0.619 . . . . 0.0 111.71 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -105.47 124.95 50.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 91.9 m -86.91 106.34 17.71 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 19' ' ' TYR . . . . . 0.626 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.7 OUTLIER -109.59 163.91 13.02 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.588 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' W' W ' 20' ' ' TYR . . . . . 0.619 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 32.8 m-85 -107.67 141.55 39.0 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.366 0.603 . . . . 0.0 109.868 -176.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 21' ' ' TYR . . . . . 0.452 ' HB3' HG22 ' W' ' 9' ' ' THR . 51.7 t80 -117.39 94.72 4.66 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -177.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 22' ' ' ASN . . . . . 0.802 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 2.4 t-20 -51.19 109.04 0.29 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.056 -1.883 . . . . 0.0 110.461 -178.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 23' ' ' ASN . . . . . 0.647 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 65.0 t30 -91.7 5.8 48.34 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 174.374 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -64.61 0.86 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.269 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -131.93 17.3 4.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 -178.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 26' ' ' LEU . . . . . 0.454 HD12 ' HA ' ' W' ' 26' ' ' LEU . 4.1 mm? 67.24 61.35 0.48 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 122.363 1.078 . . . . 0.0 110.919 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 27' ' ' GLU . . . . . 0.585 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 2.4 tt0 -112.99 160.79 17.75 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.622 -1.626 . . . . 0.0 109.465 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 28' ' ' SER . . . . . 0.515 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 34.4 m -114.45 147.4 39.34 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 122.05 -0.406 . . . . 0.0 111.404 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 29' ' ' THR . . . . . 0.619 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 3.2 p -143.45 137.21 28.43 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 30' ' ' TRP . . . . . 0.638 ' CD1' HG21 ' P' ' 105' ' ' ILE . 72.3 m95 -72.15 -61.88 1.63 Allowed 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.729 -0.607 . . . . 0.0 110.652 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 31' ' ' GLU . . . . . 0.509 ' OE1' ' HG2' ' W' ' 32' ' ' LYS . 3.0 pt-20 -105.63 -161.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 119.347 -0.941 . . . . 0.0 111.138 172.169 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 32' ' ' LYS . . . . . 0.509 ' HG2' ' OE1' ' W' ' 31' ' ' GLU . 9.8 ptpp? -61.42 139.54 94.86 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-O 121.983 0.897 . . . . 0.0 113.055 -167.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 33' ' ' PRO . . . . . 0.638 ' HD2' HD21 ' W' ' 36' ' ' LEU . 71.5 Cg_exo -64.53 -178.62 0.71 Allowed 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 124.41 3.407 . . . . 0.0 114.116 172.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -51.36 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.57 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -94.5 3.46 55.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.452 -172.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' W' W ' 36' ' ' LEU . . . . . 0.638 HD21 ' HD2' ' W' ' 33' ' ' PRO . 6.5 tp -87.63 95.19 9.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.68 0.753 . . . . 0.0 109.775 177.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 pttm . . . . . 0 C--O 1.244 0.783 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.726 179.962 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo . . . . . 0 N--CA 1.481 0.737 0 N-CA-C 109.992 -0.811 . . . . 0.0 109.992 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' P' P ' 102' ' ' PRO . . . . . 0.422 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.51 148.99 23.79 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.38 2.053 . . . . 0.0 111.98 -177.738 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 103' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.1 Cg_exo -78.12 148.51 24.54 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.852 2.368 . . . . 0.0 112.379 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.7 148.76 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 169.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' P' P ' 105' ' ' ILE . . . . . 0.652 HG23 ' O ' ' P' ' 106' ' ' PRO . 2.0 mp -77.88 148.97 76.53 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.652 ' O ' HG23 ' P' ' 105' ' ' ILE . 73.2 Cg_endo -78.34 148.81 24.13 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 121.614 1.542 . . . . 0.0 109.614 166.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 107' ' ' PRO . . . . . 0.466 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 73.7 Cg_endo -78.39 149.12 24.25 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.332 1.355 . . . . 0.0 113.14 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 108' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 3.8 Cg_exo -78.27 149.2 24.68 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.055 2.503 . . . . 0.0 111.601 172.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 109' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo . . . . . 0 C--O 1.25 1.111 0 C-N-CA 122.699 2.266 . . . . 0.0 111.369 175.831 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.821 0 N-CA-C 111.616 -0.594 . . . . 0.0 111.616 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.81 -26.72 11.64 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.814 0.34 . . . . 0.0 111.029 -177.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 9.7 t -83.36 125.73 31.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.27 0.557 . . . . 0.0 110.323 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.94 164.93 12.9 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.473 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 5' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' W' ' 6' ' ' SER . 28.8 m -126.74 160.73 34.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.696 -179.188 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 6' ' ' SER . . . . . 0.539 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 33.1 t 171.09 -153.69 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 7' ' ' GLU . . . . . 0.521 ' OE1' ' HD2' ' W' ' 24' ' ' ARG . 27.7 mt-10 63.0 79.89 0.25 Allowed 'General case' 0 N--CA 1.444 -0.725 0 CA-C-O 122.173 0.987 . . . . 0.0 108.808 -176.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 8' ' ' TRP . . . . . 0.656 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 36.0 m95 -124.08 124.73 43.17 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.833 -172.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 9' ' ' THR . . . . . 0.666 HG22 ' HB3' ' W' ' 21' ' ' TYR . 0.2 OUTLIER -112.43 176.84 4.85 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-O 122.117 0.961 . . . . 0.0 111.13 174.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' W' W ' 10' ' ' GLU . . . . . 0.487 ' N ' ' OG1' ' W' ' 9' ' ' THR . 43.3 mt-10 -111.95 118.9 36.76 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.822 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -123.96 119.12 28.66 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.837 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 12' ' ' LYS . . . . . 0.524 ' H ' ' HD2' ' W' ' 12' ' ' LYS . 0.0 OUTLIER -104.18 123.68 47.74 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.766 176.86 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 10.8 p -82.21 177.0 9.03 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.0 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.87 -26.86 62.67 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -175.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -76.83 -28.16 55.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.499 -178.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.78 29.27 5.34 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.299 -0.721 . . . . 0.0 111.299 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 17' ' ' LYS . . . . . 0.456 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 40.9 mmtm -96.74 123.34 40.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.468 -0.366 . . . . 0.0 110.402 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 51.9 m -86.53 106.37 17.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.357 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 19' ' ' TYR . . . . . 0.719 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 2.5 p90 -117.98 169.62 9.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.037 0.446 . . . . 0.0 110.306 175.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 20' ' ' TYR . . . . . 0.573 ' HB2' HG21 ' W' ' 29' ' ' THR . 34.9 m-85 -107.8 139.42 42.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.927 -177.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 21' ' ' TYR . . . . . 0.666 ' HB3' HG22 ' W' ' 9' ' ' THR . 58.6 t80 -116.98 99.12 6.86 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 -175.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 22' ' ' ASN . . . . . 0.656 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.9 t-20 -56.62 108.87 0.54 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.27 -177.28 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.97 4.44 50.08 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 24' ' ' ARG . . . . . 0.596 ' HB3' HD22 ' W' ' 22' ' ' ASN . 23.6 tpt180 -63.75 -63.67 1.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.697 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 16.6 p -130.44 20.84 5.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.267 177.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 26' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' W' ' 26' ' ' LEU . 0.3 OUTLIER 67.1 85.36 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.279 -175.813 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' W' W ' 27' ' ' GLU . . . . . 0.518 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 7.0 tp10 -142.17 160.29 40.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.172 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 28' ' ' SER . . . . . 0.528 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 6.3 m -114.54 140.11 49.03 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.261 -0.274 . . . . 0.0 110.718 172.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 29' ' ' THR . . . . . 0.573 HG21 ' HB2' ' W' ' 20' ' ' TYR . 1.7 t -144.23 136.37 26.4 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.521 176.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 30' ' ' TRP . . . . . 0.719 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 89.9 m95 -69.88 -70.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.704 0.288 . . . . 0.0 110.822 -174.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mp0 -86.94 -177.15 5.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.27 0.557 . . . . 0.0 111.054 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 32' ' ' LYS . . . . . 0.467 ' HD2' ' HB2' ' W' ' 37' ' ' LYS . 25.3 pttm -69.62 147.39 96.55 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.678 -174.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 33' ' ' PRO . . . . . 0.623 ' HD2' HD23 ' W' ' 36' ' ' LEU . 53.4 Cg_exo -64.71 163.94 25.87 Favored 'Trans proline' 0 C--N 1.336 -0.113 0 C-N-CA 123.573 2.848 . . . . 0.0 113.003 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -71.31 -27.66 63.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.147 -175.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.09 -20.52 21.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.455 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 36' ' ' LEU . . . . . 0.623 HD23 ' HD2' ' W' ' 33' ' ' PRO . 9.7 tp -97.1 101.65 13.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.811 -173.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' W' W ' 37' ' ' LYS . . . . . 0.467 ' HB2' ' HD2' ' W' ' 32' ' ' LYS . 27.9 mtpp . . . . . 0 C--O 1.245 0.828 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.591 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo . . . . . 0 N--CA 1.478 0.604 0 N-CA-C 111.072 -0.396 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' P' P ' 102' ' ' PRO . . . . . 0.401 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.3 Cg_exo -77.71 148.65 25.87 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.946 2.431 . . . . 0.0 111.06 176.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 103' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.63 148.56 26.04 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.377 2.052 . . . . 0.0 112.661 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.29 149.19 33.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.926 172.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' P' P ' 105' ' ' ILE . . . . . 0.707 HG21 ' CD1' ' W' ' 30' ' ' TRP . 1.8 mp -78.19 148.62 74.93 Favored Pre-proline 0 C--N 1.32 -0.684 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.298 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.608 ' O ' HG23 ' P' ' 105' ' ' ILE . 73.0 Cg_endo -78.15 148.68 24.59 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.678 2.252 . . . . 0.0 111.126 164.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 107' ' ' PRO . . . . . 0.401 ' HD3' ' HA ' ' P' ' 106' ' ' PRO . 4.4 Cg_exo -78.28 148.9 24.4 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.118 1.879 . . . . 0.0 111.093 171.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 108' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 2.8 Cg_exo -77.58 148.53 26.16 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 121.503 1.469 . . . . 0.0 111.383 176.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 109' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 5.7 Cg_exo . . . . . 0 C--O 1.249 1.053 0 C-N-CA 123.248 2.632 . . . . 0.0 112.491 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.728 0 CA-C-O 119.988 -0.34 . . . . 0.0 112.353 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . 73.97 3.38 4.42 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.536 0.735 . . . . 0.0 112.299 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 68.7 p 53.51 -173.87 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.868 0.867 . . . . 0.0 112.325 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . 68.17 81.42 0.19 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.03 0.532 . . . . 0.0 111.269 177.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 m -70.49 109.11 2.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.66 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 6' ' ' SER . . . . . 0.523 ' O ' ' HB2' ' W' ' 7' ' ' GLU . 18.5 t -170.55 -153.57 0.1 Allowed 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.79 -177.465 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 7' ' ' GLU . . . . . 0.964 ' HB3' ' HB2' ' W' ' 23' ' ' ASN . 0.9 OUTLIER 74.51 79.04 0.11 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.381 1.051 . . . . 0.0 108.423 -171.64 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' W' W ' 8' ' ' TRP . . . . . 0.648 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 20.7 m95 -124.73 112.26 16.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 109.834 -172.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 9' ' ' THR . . . . . 0.919 HG22 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -100.01 167.41 10.51 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 122.331 1.062 . . . . 0.0 111.673 176.013 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' W' W ' 10' ' ' GLU . . . . . 0.404 ' N ' ' OG1' ' W' ' 9' ' ' THR . 8.3 pt-20 -102.94 112.33 25.1 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 112.594 -2.094 . . . . 0.0 110.359 -176.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 11' ' ' TYR . . . . . 0.438 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 3.4 m-85 -124.01 110.15 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.009 -175.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -99.22 123.34 43.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.702 175.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 69.0 p -81.83 170.8 15.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.477 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -13.02 62.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -80.69 -16.7 53.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.654 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.8 13.72 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.06 -0.591 . . . . 0.0 111.744 -176.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -104.35 124.24 48.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.544 0.211 . . . . 0.0 110.805 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 87.7 m -87.04 103.57 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.72 175.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 19' ' ' TYR . . . . . 0.686 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 1.1 p90 -118.17 166.14 12.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.202 0.525 . . . . 0.0 110.653 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 20' ' ' TYR . . . . . 0.694 ' HB2' HG23 ' W' ' 29' ' ' THR . 35.8 m-85 -107.92 144.61 34.94 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.313 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 21' ' ' TYR . . . . . 0.919 ' HB3' HG22 ' W' ' 9' ' ' THR . 50.9 t80 -117.1 114.04 23.15 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 22' ' ' ASN . . . . . 0.74 ' OD1' ' HB3' ' W' ' 24' ' ' ARG . 4.8 t30 -74.68 101.95 4.44 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.767 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 23' ' ' ASN . . . . . 0.964 ' HB2' ' HB3' ' W' ' 7' ' ' GLU . 79.1 m-20 -80.81 -10.03 59.76 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 24' ' ' ARG . . . . . 0.74 ' HB3' ' OD1' ' W' ' 22' ' ' ASN . 15.4 ttp180 -49.9 -59.51 3.79 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.125 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 25' ' ' THR . . . . . 0.677 ' H ' ' ND2' ' W' ' 22' ' ' ASN . 8.8 p -132.12 17.66 4.55 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.2 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 62.79 81.86 0.19 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.005 -172.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 27' ' ' GLU . . . . . 0.628 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.4 tp10 -142.03 167.53 21.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.54 -178.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 28' ' ' SER . . . . . 0.574 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -114.58 143.48 44.93 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 172.186 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' W' W ' 29' ' ' THR . . . . . 0.694 HG23 ' HB2' ' W' ' 20' ' ' TYR . 1.5 t -144.05 137.08 27.37 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 173.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 30' ' ' TRP . . . . . 0.686 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 92.4 m95 -69.89 -82.14 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.661 0.267 . . . . 0.0 111.464 -174.242 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -105.24 -155.79 0.55 Allowed 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.897 -172.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -53.12 115.82 8.21 Favored Pre-proline 0 N--CA 1.464 0.243 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -168.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 33' ' ' PRO . . . . . 0.47 ' HB2' ' HB3' ' W' ' 36' ' ' LEU . 36.5 Cg_exo -65.09 148.31 89.2 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 123.203 2.602 . . . . 0.0 111.286 169.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.63 -37.93 68.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.452 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -94.84 24.82 4.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.001 0.429 . . . . 0.0 111.174 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' W' W ' 36' ' ' LEU . . . . . 0.561 HD23 ' CD1' ' W' ' 8' ' ' TRP . 34.8 tp -156.45 43.2 0.39 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.011 0.91 . . . . 0.0 108.811 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' W' W ' 37' ' ' LYS . . . . . 0.562 ' HZ1' ' HB3' ' W' ' 37' ' ' LYS . 8.2 mtpm? . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.597 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 101' ' ' PRO . . . . . 0.476 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 1.7 Cg_endo . . . . . 0 N--CA 1.474 0.377 0 N-CA-C 110.187 -0.736 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 102' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' P' ' 101' ' ' PRO . 4.9 Cg_exo -78.06 148.95 25.09 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.928 2.419 . . . . 0.0 111.99 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 103' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.94 148.68 25.23 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.545 2.163 . . . . 0.0 111.629 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 104' ' ' LEU . . . . . 0.44 ' O ' HD12 ' P' ' 104' ' ' LEU . 3.5 pp -78.05 148.91 34.08 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.367 173.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 105' ' ' ILE . . . . . 0.63 HD12 ' H ' ' P' ' 105' ' ' ILE . 1.7 mp -78.45 148.81 74.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.603 ' O ' HG23 ' P' ' 105' ' ' ILE . 60.2 Cg_endo -78.14 148.88 24.79 Favored 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.07 1.846 . . . . 0.0 110.682 162.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -77.95 149.14 25.6 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.625 1.55 . . . . 0.0 112.111 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 108' ' ' PRO . . . . . 0.466 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 5.6 Cg_exo -78.0 148.74 25.11 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.298 1.998 . . . . 0.0 112.106 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 109' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 2.6 Cg_exo . . . . . 0 C--O 1.249 1.042 0 C-N-CA 123.372 2.715 . . . . 0.0 111.233 174.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.797 0 N-CA-C 112.164 -0.374 . . . . 0.0 112.164 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.21 151.98 50.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 13.2 t -167.71 178.93 5.05 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . 64.1 176.74 0.18 Allowed 'General case' 0 C--O 1.237 0.423 0 O-C-N 124.058 0.849 . . . . 0.0 112.1 177.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 5' ' ' VAL . . . . . 0.515 HG21 ' HB2' ' W' ' 34' ' ' GLN . 12.5 m -113.2 119.62 61.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.558 0.694 . . . . 0.0 110.841 174.088 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 6' ' ' SER . . . . . 0.771 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.1 t -169.83 -158.73 0.19 Allowed 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -176.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 61.77 77.73 0.32 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -168.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 8' ' ' TRP . . . . . 0.79 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 45.1 m95 -124.19 124.74 43.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.464 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 9' ' ' THR . . . . . 0.664 HG21 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -108.62 167.99 9.65 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-O 122.651 1.215 . . . . 0.0 111.89 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' W' W ' 10' ' ' GLU . . . . . 0.438 ' N ' ' OG1' ' W' ' 9' ' ' THR . 0.7 OUTLIER -106.54 115.99 31.16 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 111.838 -2.437 . . . . 0.0 110.455 -177.825 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -124.08 116.03 22.12 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.537 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 12' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' W' ' 17' ' ' LYS . 48.5 mtmt -103.69 113.24 26.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 77.2 p -79.92 173.98 12.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.161 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.88 -6.0 38.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.543 . . . . 0.0 111.102 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -84.99 -3.66 58.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.766 178.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.8 28.24 55.09 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 17' ' ' LYS . . . . . 0.432 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.3 mmtm -105.94 126.44 52.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.761 -175.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 95.8 m -88.3 101.84 14.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.041 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 19' ' ' TYR . . . . . 0.631 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.5 OUTLIER -115.64 163.52 15.68 Favored 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.377 178.406 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' W' W ' 20' ' ' TYR . . . . . 0.621 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 26.9 m-85 -107.81 143.11 36.85 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 121.454 0.645 . . . . 0.0 109.763 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 21' ' ' TYR . . . . . 0.664 ' HB3' HG21 ' W' ' 9' ' ' THR . 58.1 t80 -117.24 100.94 8.04 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 22' ' ' ASN . . . . . 0.79 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 3.8 t-20 -55.28 111.92 0.98 Allowed 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.52 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -98.52 5.02 48.27 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -61.33 -65.51 0.68 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.16 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 25' ' ' THR . . . . . 0.422 ' O ' ' HB2' ' W' ' 26' ' ' LEU . 8.8 t -132.16 18.18 4.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.089 177.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 26' ' ' LEU . . . . . 0.422 ' HB2' ' O ' ' W' ' 25' ' ' THR . 4.3 mm? 71.06 85.04 0.13 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.221 -177.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 27' ' ' GLU . . . . . 0.515 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 1.6 tt0 -141.66 161.24 38.41 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.224 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 28' ' ' SER . . . . . 0.44 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 31.2 m -114.4 146.41 40.62 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 121.836 -0.54 . . . . 0.0 111.017 174.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 29' ' ' THR . . . . . 0.621 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 4.3 p -143.35 134.34 25.55 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 30' ' ' TRP . . . . . 0.645 ' CD1' HG22 ' P' ' 105' ' ' ILE . 80.6 m95 -69.76 -64.69 0.83 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.577 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -105.37 -164.4 1.03 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 32' ' ' LYS . . . . . 0.864 ' HD3' ' HA ' ' W' ' 37' ' ' LYS . 56.6 mttp -52.91 132.61 48.74 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 33' ' ' PRO . . . . . 0.526 ' HG2' HD23 ' W' ' 36' ' ' LEU . 35.8 Cg_exo -65.33 -159.78 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.497 3.464 . . . . 0.0 113.916 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 34' ' ' GLN . . . . . 0.515 ' HB2' HG21 ' W' ' 5' ' ' VAL . 49.9 mt-30 -78.69 -68.04 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.178 -173.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -85.0 -8.55 58.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.176 0.512 . . . . 0.0 110.865 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' W' W ' 36' ' ' LEU . . . . . 0.526 HD23 ' HG2' ' W' ' 33' ' ' PRO . 38.0 tp -98.79 98.71 9.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.871 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' W' W ' 37' ' ' LYS . . . . . 0.864 ' HA ' ' HD3' ' W' ' 32' ' ' LYS . 62.6 pttt . . . . . 0 C--O 1.246 0.88 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.202 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.476 0.485 0 N-CA-C 110.092 -0.772 . . . . 0.0 110.092 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' P' P ' 102' ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.27 149.14 24.61 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.63 2.22 . . . . 0.0 112.382 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 103' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.7 Cg_exo -78.0 148.87 25.21 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.244 2.629 . . . . 0.0 111.277 174.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 86.3 mt -78.09 149.09 33.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.016 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 105' ' ' ILE . . . . . 0.645 HG22 ' CD1' ' W' ' 30' ' ' TRP . 1.5 mp -78.52 148.55 73.68 Favored Pre-proline 0 C--N 1.326 -0.431 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.626 ' O ' HG21 ' P' ' 105' ' ' ILE . 72.0 Cg_endo -77.78 148.59 25.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.927 1.752 . . . . 0.0 110.078 164.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 107' ' ' PRO . . . . . 0.472 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 72.7 Cg_endo -78.25 148.9 24.49 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.644 1.563 . . . . 0.0 112.468 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 108' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 5.2 Cg_exo -77.76 148.76 25.85 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.894 2.396 . . . . 0.0 111.342 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' P' P ' 109' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 3.5 Cg_exo . . . . . 0 C--O 1.251 1.139 0 C-N-CA 122.609 2.206 . . . . 0.0 111.753 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.905 -0.478 . . . . 0.0 111.905 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.26 -39.39 15.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.085 0.469 . . . . 0.0 111.059 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 7.0 t -89.23 123.01 33.06 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.237 0.542 . . . . 0.0 109.736 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -141.23 100.14 3.73 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.505 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 5' ' ' VAL . . . . . 0.41 ' HB ' ' OE2' ' W' ' 35' ' ' GLU . 9.3 m -82.08 74.69 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.44 0.638 . . . . 0.0 109.912 176.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 6' ' ' SER . . . . . 0.445 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 9.3 t -171.93 -152.92 0.08 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.883 -177.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 68.6 83.91 0.16 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.422 1.106 . . . . 0.0 109.314 -169.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 8' ' ' TRP . . . . . 0.73 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 49.0 m95 -124.94 114.87 19.73 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.729 -1.578 . . . . 0.0 108.662 -175.334 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 9' ' ' THR . . . . . 0.602 HG21 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -99.93 173.58 6.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.94 0.876 . . . . 0.0 112.056 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' W' W ' 10' ' ' GLU . . . . . 0.454 ' N ' ' OG1' ' W' ' 9' ' ' THR . 37.9 mt-10 -106.84 117.04 33.0 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 113.786 -1.552 . . . . 0.0 110.111 -176.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -127.02 106.69 9.45 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.686 -179.14 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -90.15 113.4 25.16 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.921 175.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.9 p -75.37 161.47 29.23 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.29 -19.8 64.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -65.67 -37.99 88.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.003 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.17 36.68 1.45 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.806 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -119.48 135.31 54.82 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 37.4 m -86.9 101.67 13.62 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 19' ' ' TYR . . . . . 0.734 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.15 162.41 18.27 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.615 178.279 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' W' W ' 20' ' ' TYR . . . . . 0.789 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 54.1 m-85 -107.71 150.62 26.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.209 -175.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 21' ' ' TYR . . . . . 0.602 ' HB3' HG21 ' W' ' 9' ' ' THR . 48.3 t80 -117.31 96.38 5.39 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.074 0.94 . . . . 0.0 108.49 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 22' ' ' ASN . . . . . 0.749 ' OD1' ' HB2' ' W' ' 24' ' ' ARG . 2.0 t30 -55.01 120.2 6.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.027 -1.897 . . . . 0.0 111.198 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -89.45 -12.79 39.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 24' ' ' ARG . . . . . 0.749 ' HB2' ' OD1' ' W' ' 22' ' ' ASN . 33.3 mtp180 -45.92 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 25' ' ' THR . . . . . 0.581 ' H ' HD22 ' W' ' 22' ' ' ASN . 14.9 t -110.98 25.16 12.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.118 175.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 26' ' ' LEU . . . . . 0.574 HD11 ' HH ' ' W' ' 21' ' ' TYR . 0.6 OUTLIER 63.8 86.69 0.12 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.171 -173.881 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' W' W ' 27' ' ' GLU . . . . . 0.585 ' N ' HD21 ' W' ' 22' ' ' ASN . 8.4 tp10 -142.26 165.1 28.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.46 -174.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 28' ' ' SER . . . . . 0.561 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 4.3 m -114.53 152.46 31.7 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.622 171.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 29' ' ' THR . . . . . 0.789 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 45.7 p -143.9 135.11 25.67 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 30' ' ' TRP . . . . . 0.734 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 77.7 m95 -69.81 -65.86 0.66 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 118.293 0.497 . . . . 0.0 110.821 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -105.33 -175.52 2.82 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.959 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 38.5 ttmt -62.74 128.9 92.48 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.636 -174.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 33' ' ' PRO . . . . . 0.487 ' HD2' ' CD1' ' W' ' 36' ' ' LEU . 50.2 Cg_exo -64.82 153.85 75.83 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.706 2.937 . . . . 0.0 112.509 171.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -63.83 -30.94 71.98 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.264 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' W' W ' 35' ' ' GLU . . . . . 0.41 ' OE2' ' HB ' ' W' ' 5' ' ' VAL . 5.6 pt-20 -85.8 6.95 25.75 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.425 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' W' W ' 36' ' ' LEU . . . . . 0.667 ' HG ' ' CD1' ' W' ' 8' ' ' TRP . 1.0 OUTLIER -103.68 110.96 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' W' W ' 37' ' ' LYS . . . . . 0.409 ' H ' ' HG3' ' W' ' 37' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.281 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.479 0.664 0 N-CA-C 110.535 -0.602 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' P' P ' 102' ' ' PRO . . . . . 0.412 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 6.0 Cg_exo -78.31 149.07 24.43 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.964 2.443 . . . . 0.0 111.249 173.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 103' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.0 Cg_exo -77.87 148.83 25.57 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.21 1.94 . . . . 0.0 111.57 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 56.1 tp -78.08 148.77 34.09 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 105' ' ' ILE . . . . . 0.625 HG22 ' CD1' ' W' ' 30' ' ' TRP . 1.1 mp -78.31 148.95 75.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.515 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 106' ' ' PRO . . . . . 0.561 ' CD ' ' HB2' ' W' ' 28' ' ' SER . 73.0 Cg_endo -78.18 148.86 24.65 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.195 2.597 . . . . 0.0 109.663 160.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -77.98 148.76 25.17 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.021 1.148 . . . . 0.0 111.535 177.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -78.02 148.97 25.25 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.461 2.107 . . . . 0.0 112.717 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' P' P ' 109' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 C--O 1.244 0.812 0 C-N-CA 122.438 2.092 . . . . 0.0 111.978 176.451 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' W' W ' 6' ' ' SER . . . . . 0.439 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.7 t . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' W' W ' 7' ' ' GLU . . . . . 0.729 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 35.8 mt-10 71.8 77.81 0.16 Allowed 'General case' 0 C--N 1.322 -0.622 0 O-C-N 124.472 1.108 . . . . 0.0 108.721 -178.206 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 8' ' ' TRP . . . . . 0.696 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 27.4 m95 -124.5 111.55 15.83 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.897 -173.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 9' ' ' THR . . . . . 0.521 HG23 ' HB3' ' W' ' 21' ' ' TYR . 2.2 t -99.69 -174.4 2.7 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 122.413 1.101 . . . . 0.0 110.468 177.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 10' ' ' GLU . . . . . 0.515 ' N ' ' OG1' ' W' ' 9' ' ' THR . 16.7 mt-10 -110.99 122.28 47.48 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.846 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 11' ' ' TYR . . . . . 0.543 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 1.9 m-85 -128.83 115.59 18.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.407 0.623 . . . . 0.0 110.046 175.014 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -96.9 120.63 37.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.067 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' W' W ' 13' ' ' THR . . . . . 0.412 ' OG1' ' HB3' ' W' ' 17' ' ' LYS . 16.4 p -90.71 165.66 13.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.334 175.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -18.4 61.38 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -171.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' W' W ' 15' ' ' ASP . . . . . 0.448 ' OD2' ' HB2' ' W' ' 17' ' ' LYS . 6.3 p-10 -84.73 -3.19 58.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 110.954 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.39 17.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.881 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' W' W ' 17' ' ' LYS . . . . . 0.448 ' HB2' ' OD2' ' W' ' 15' ' ' ASP . 14.7 tppt? -97.86 130.21 44.78 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -177.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.7 94.06 9.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' W' W ' 19' ' ' TYR . . . . . 0.625 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.0 OUTLIER -108.11 157.58 18.15 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.748 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' W' W ' 20' ' ' TYR . . . . . 0.699 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 85.5 m-85 -107.98 145.55 33.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.556 0.693 . . . . 0.0 110.232 -173.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 21' ' ' TYR . . . . . 0.521 ' HB3' HG23 ' W' ' 9' ' ' THR . 40.8 t80 -117.53 101.71 8.59 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 22' ' ' ASN . . . . . 0.696 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.3 t-20 -56.92 113.83 1.84 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 113.602 -1.636 . . . . 0.0 110.434 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 23' ' ' ASN . . . . . 0.729 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 5.9 t30 -92.28 -7.28 48.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 24' ' ' ARG . . . . . 0.45 ' HB3' HD21 ' W' ' 22' ' ' ASN . 0.5 OUTLIER -54.89 -60.63 3.1 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.226 -176.369 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' W' W ' 25' ' ' THR . . . . . 0.411 HG23 ' HD2' ' W' ' 24' ' ' ARG . 10.1 p -132.24 20.73 4.42 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.393 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 26' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' W' ' 26' ' ' LEU . 0.5 OUTLIER 65.1 81.92 0.2 Allowed 'General case' 0 CA--C 1.531 0.233 0 O-C-N 123.79 0.681 . . . . 0.0 110.265 -174.919 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' W' W ' 27' ' ' GLU . . . . . 0.477 ' HB3' ' CB ' ' W' ' 22' ' ' ASN . 9.9 tp10 -141.96 166.37 24.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.047 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 28' ' ' SER . . . . . 0.477 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -114.35 149.83 35.49 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 122.077 -0.389 . . . . 0.0 111.008 174.648 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' W' W ' 29' ' ' THR . . . . . 0.699 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 15.0 p -143.43 138.53 29.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 172.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 30' ' ' TRP . . . . . 0.625 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 90.4 m95 -70.21 -70.78 0.27 Allowed 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.682 178.117 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.0 -160.65 0.77 Allowed 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.88 -179.021 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 32' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' W' ' 33' ' ' PRO . 97.3 mttt -57.39 128.68 79.26 Favored Pre-proline 0 C--O 1.231 0.117 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 33' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' W' ' 36' ' ' LEU . 74.3 Cg_exo -64.59 -178.82 0.76 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.51 3.474 . . . . 0.0 113.594 170.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -72.23 -52.29 17.11 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.426 -177.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -80.0 -23.48 41.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 111.372 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' W' W ' 36' ' ' LEU . . . . . 0.558 HD22 ' CD1' ' W' ' 8' ' ' TRP . 12.8 tp -84.87 101.45 12.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.564 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 46.9 mttp . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.692 -167.89 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo . . . . . 0 N--CA 1.481 0.783 0 N-CA-C 109.464 -1.014 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' P' P ' 102' ' ' PRO . . . . . 0.503 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 72.5 Cg_endo -77.99 148.66 25.05 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.51 1.473 . . . . 0.0 113.061 -177.032 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 103' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.6 Cg_exo -78.22 148.94 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.958 3.106 . . . . 0.0 111.543 171.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 104' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' P' ' 104' ' ' LEU . 4.3 mm? -78.12 148.63 34.09 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 167.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 105' ' ' ILE . . . . . 0.704 HG22 ' O ' ' P' ' 106' ' ' PRO . 2.0 mp -78.48 148.56 73.82 Favored Pre-proline 0 C--N 1.322 -0.592 0 C-N-CA 120.333 -0.547 . . . . 0.0 109.681 176.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 106' ' ' PRO . . . . . 0.704 ' O ' HG22 ' P' ' 105' ' ' ILE . 71.7 Cg_endo -78.16 148.69 24.57 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 121.825 1.683 . . . . 0.0 110.396 163.011 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 107' ' ' PRO . . . . . 0.489 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 5.7 Cg_exo -78.07 148.84 24.98 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.163 1.242 . . . . 0.0 111.878 177.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' P' P ' 108' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 2.8 Cg_exo . . . . . 0 N--CA 1.458 -0.587 0 C-N-CA 122.731 2.288 . . . . 0.0 111.083 171.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 6' ' ' SER . . . . . . . . . . . . . 21.3 t . . . . . 0 C--O 1.235 0.313 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' W' W ' 7' ' ' GLU . . . . . 0.406 ' HB3' ' HB2' ' W' ' 23' ' ' ASN . 46.2 mt-10 72.85 85.26 0.12 Allowed 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 124.637 1.21 . . . . 0.0 109.538 -176.569 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 8' ' ' TRP . . . . . 0.555 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 47.3 m95 -124.29 134.89 53.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 113.745 -1.57 . . . . 0.0 110.041 -176.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 9' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 1.5 t -121.32 -179.19 3.99 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 122.414 1.102 . . . . 0.0 110.702 174.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 10' ' ' GLU . . . . . 0.497 ' N ' ' OG1' ' W' ' 9' ' ' THR . 38.4 mt-10 -112.05 119.46 38.54 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 112.515 -2.13 . . . . 0.0 109.492 -178.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -123.73 88.59 2.94 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.817 0.817 . . . . 0.0 109.554 175.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -80.24 107.3 12.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.887 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 70.8 p -74.86 173.61 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.054 0.454 . . . . 0.0 111.78 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.5 -18.08 64.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.996 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.4 -23.09 62.7 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.883 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.18 29.93 10.77 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.668 -175.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 37.1 tptt -107.19 131.98 53.56 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 -176.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.2 m -87.41 97.97 11.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.701 0.286 . . . . 0.0 110.37 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 19' ' ' TYR . . . . . 0.608 ' CD2' HD11 ' P' ' 105' ' ' ILE . 0.2 OUTLIER -118.31 161.87 19.21 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.102 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' W' W ' 20' ' ' TYR . . . . . 0.681 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 52.8 m-85 -107.66 144.5 34.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.99 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 21' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -117.16 126.17 52.38 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 22' ' ' ASN . . . . . 1.097 HD22 ' HB3' ' W' ' 24' ' ' ARG . 37.2 t30 -91.17 120.62 32.26 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.024 -1.444 . . . . 0.0 111.396 -170.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 23' ' ' ASN . . . . . 0.406 ' HB2' ' HB3' ' W' ' 7' ' ' GLU . 19.5 m120 -91.58 2.41 56.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.868 172.081 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 24' ' ' ARG . . . . . 1.097 ' HB3' HD22 ' W' ' 22' ' ' ASN . 60.9 ttt180 -59.94 -68.3 0.3 Allowed 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.664 0.745 . . . . 0.0 110.573 -178.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 25' ' ' THR . . . . . 0.618 HG23 ' HG2' ' W' ' 24' ' ' ARG . 21.9 p -126.47 21.66 7.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.577 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 63.92 76.03 0.37 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.117 -173.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 27' ' ' GLU . . . . . 0.829 ' HB3' HD21 ' W' ' 22' ' ' ASN . 5.5 tp10 -127.76 159.0 36.13 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.457 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 28' ' ' SER . . . . . 0.646 ' HB3' HG23 ' P' ' 105' ' ' ILE . 0.1 OUTLIER -114.59 151.46 33.41 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 171.41 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' W' W ' 29' ' ' THR . . . . . 0.681 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 11.3 p -143.55 131.25 21.33 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 30' ' ' TRP . . . . . 0.568 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 94.7 m95 -69.92 -50.49 41.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 0.0 110.222 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -105.41 -167.97 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.001 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -77.81 140.38 62.95 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.448 -174.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 33' ' ' PRO . . . . . 0.953 ' HD2' HD23 ' W' ' 36' ' ' LEU . 54.0 Cg_exo -64.35 161.5 34.28 Favored 'Trans proline' 0 N--CA 1.474 0.364 0 C-N-CA 123.383 2.722 . . . . 0.0 112.231 170.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -95.82 -17.82 20.86 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.028 0.442 . . . . 0.0 110.568 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' W' W ' 35' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' W' ' 35' ' ' GLU . 4.3 pt-20 -80.93 -9.71 59.8 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.714 0.768 . . . . 0.0 109.038 170.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 36' ' ' LEU . . . . . 0.953 HD23 ' HD2' ' W' ' 33' ' ' PRO . 24.2 tp -101.88 113.25 26.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.978 174.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.436 -0.792 . . . . 0.0 110.42 -173.667 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo . . . . . 0 N--CA 1.477 0.512 0 N-CA-C 109.602 -0.961 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' P' P ' 102' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.3 Cg_endo -78.02 148.94 25.21 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.393 2.062 . . . . 0.0 111.987 177.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 103' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.4 Cg_exo -78.12 148.57 24.58 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.01 177.14 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 104' ' ' LEU . . . . . 0.687 ' H ' HD23 ' P' ' 104' ' ' LEU . 2.4 pt? -77.91 148.79 34.39 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 173.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 105' ' ' ILE . . . . . 0.646 HG23 ' HB3' ' W' ' 28' ' ' SER . 2.0 mp -78.34 148.78 74.7 Favored Pre-proline 0 C--N 1.319 -0.738 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 170.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 106' ' ' PRO . . . . . 0.623 ' O ' HG22 ' P' ' 105' ' ' ILE . 72.4 Cg_endo -78.19 148.92 24.68 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 121.176 1.25 . . . . 0.0 110.477 163.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.38 149.15 24.29 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.334 2.023 . . . . 0.0 111.544 172.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo . . . . . 0 N--CA 1.46 -0.482 0 C-N-CA 121.877 1.718 . . . . 0.0 111.167 177.427 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' W' W ' 6' ' ' SER . . . . . 0.535 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 96.9 p . . . . . 0 N--CA 1.435 -1.2 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 73.68 77.79 0.13 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -172.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 8' ' ' TRP . . . . . 0.623 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 43.5 m95 -124.03 125.94 45.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.282 -174.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 9' ' ' THR . . . . . 0.478 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 9.9 t -115.98 -171.63 2.02 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.617 1.199 . . . . 0.0 110.513 173.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 10' ' ' GLU . . . . . 0.606 ' HB3' ' HE3' ' W' ' 12' ' ' LYS . 40.4 mt-10 -112.33 122.13 46.84 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.372 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -127.37 107.22 9.78 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.417 0.627 . . . . 0.0 110.396 176.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 12' ' ' LYS . . . . . 0.606 ' HE3' ' HB3' ' W' ' 10' ' ' GLU . 0.0 OUTLIER -100.61 118.39 36.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.327 -178.799 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.6 p -75.0 168.24 20.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.673 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.42 -23.76 66.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.307 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -85.14 -10.63 56.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.441 178.159 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.86 58.81 1.15 Allowed Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.007 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 17' ' ' LYS . . . . . 0.58 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.7 mmtm -119.14 144.0 46.89 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.9 m -99.34 95.71 7.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.275 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 19' ' ' TYR . . . . . 0.742 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.35 165.69 13.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.915 175.768 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' W' W ' 20' ' ' TYR . . . . . 0.623 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 42.2 m-85 -107.67 144.69 34.39 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.261 0.553 . . . . 0.0 109.822 -175.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 21' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -117.3 99.34 6.95 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.337 1.065 . . . . 0.0 108.44 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 22' ' ' ASN . . . . . 0.886 ' ND2' ' HE ' ' W' ' 24' ' ' ARG . 17.7 t-20 -57.17 101.65 0.07 Allowed 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 112.737 -2.029 . . . . 0.0 110.944 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -84.31 -1.52 55.5 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 24' ' ' ARG . . . . . 0.886 ' HE ' ' ND2' ' W' ' 22' ' ' ASN . 19.7 ttp180 -56.36 -61.41 2.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.893 177.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 5.2 p -132.4 19.35 4.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.612 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 26' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' W' ' 26' ' ' LEU . 0.5 OUTLIER 63.96 81.82 0.2 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.527 0.68 . . . . 0.0 109.8 -173.268 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' W' W ' 27' ' ' GLU . . . . . 0.587 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.2 tp10 -142.3 165.64 26.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.215 -178.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 28' ' ' SER . . . . . 0.552 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 14.8 m -114.75 151.92 32.93 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.523 0.201 . . . . 0.0 111.535 173.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 29' ' ' THR . . . . . 0.623 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 10.5 p -143.84 137.02 27.65 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 172.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 30' ' ' TRP . . . . . 0.795 ' CH2' HD13 ' P' ' 105' ' ' ILE . 80.1 m95 -69.84 -57.99 4.41 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 121.774 -0.579 . . . . 0.0 110.459 176.562 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -105.17 -174.06 2.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.994 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 32' ' ' LYS . . . . . 0.476 ' HD3' ' OXT' ' W' ' 37' ' ' LYS . 60.3 mttp -52.74 142.46 33.06 Favored Pre-proline 0 C--O 1.238 0.493 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.751 -178.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 33' ' ' PRO . . . . . 0.509 ' HG2' HD23 ' W' ' 36' ' ' LEU . 46.1 Cg_exo -64.84 -165.79 0.08 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.013 3.142 . . . . 0.0 113.256 171.89 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -92.61 -40.76 10.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.569 -172.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' W' W ' 35' ' ' GLU . . . . . 0.415 ' H ' ' CD ' ' W' ' 35' ' ' GLU . 0.0 OUTLIER -97.22 -28.3 14.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.025 178.663 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' W' W ' 36' ' ' LEU . . . . . 0.509 HD23 ' HG2' ' W' ' 33' ' ' PRO . 24.7 tp -77.25 84.91 3.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.405 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' W' W ' 37' ' ' LYS . . . . . 0.476 ' OXT' ' HD3' ' W' ' 32' ' ' LYS . 56.1 mttp . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.101 174.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo . . . . . 0 N--CA 1.479 0.653 0 N-CA-C 110.205 -0.729 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' P' P ' 102' ' ' PRO . . . . . 0.514 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.9 Cg_endo -77.82 148.74 25.62 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.44 2.093 . . . . 0.0 112.239 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 103' ' ' PRO . . . . . 0.514 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 9.9 Cg_exo -77.69 148.87 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 123.422 2.748 . . . . 0.0 111.637 174.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 82.1 mt -78.28 148.98 33.64 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' P' P ' 105' ' ' ILE . . . . . 0.795 HD13 ' CH2' ' W' ' 30' ' ' TRP . 2.1 mp -77.87 148.97 76.6 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 120.251 -0.579 . . . . 0.0 109.513 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 106' ' ' PRO . . . . . 0.552 ' CD ' ' HB2' ' W' ' 28' ' ' SER . 72.1 Cg_endo -78.13 148.6 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.698 1.599 . . . . 0.0 109.944 165.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.32 148.94 24.32 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.609 2.206 . . . . 0.0 112.872 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo . . . . . 0 N--CA 1.457 -0.618 0 C-N-CA 122.025 1.817 . . . . 0.0 109.617 166.016 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' W' W ' 6' ' ' SER . . . . . 0.544 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 52.8 m . . . . . 0 N--CA 1.442 -0.841 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 7' ' ' GLU . . . . . 0.666 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 39.6 mm-40 67.77 80.45 0.21 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -170.392 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 8' ' ' TRP . . . . . 0.804 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 25.2 m95 -124.61 111.24 15.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.716 -170.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 9' ' ' THR . . . . . 0.476 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 0.6 OUTLIER -99.91 172.39 7.26 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.812 1.291 . . . . 0.0 111.5 175.814 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' W' W ' 10' ' ' GLU . . . . . 0.476 ' N ' ' OG1' ' W' ' 9' ' ' THR . 8.4 pt-20 -108.57 119.89 40.83 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 112.012 -2.358 . . . . 0.0 110.225 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -124.48 105.34 9.32 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.527 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.13 115.15 25.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.575 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -79.83 170.24 16.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.736 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.78 -16.84 62.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.779 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -84.94 0.18 52.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.259 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.86 26.35 60.65 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.001 -0.619 . . . . 0.0 111.71 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -105.47 124.95 50.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 91.9 m -86.91 106.34 17.71 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 19' ' ' TYR . . . . . 0.649 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.7 OUTLIER -109.59 163.91 13.02 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.588 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' W' W ' 20' ' ' TYR . . . . . 0.629 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 32.8 m-85 -107.67 141.55 39.0 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.366 0.603 . . . . 0.0 109.868 -176.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 21' ' ' TYR . . . . . 0.476 ' HB3' HG23 ' W' ' 9' ' ' THR . 51.7 t80 -117.39 94.72 4.66 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -177.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 22' ' ' ASN . . . . . 0.804 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 2.4 t-20 -51.19 109.04 0.29 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.056 -1.883 . . . . 0.0 110.461 -178.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 23' ' ' ASN . . . . . 0.666 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 65.0 t30 -91.7 5.8 48.34 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 174.374 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -64.61 0.86 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.269 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -131.93 17.3 4.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 -178.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 26' ' ' LEU . . . . . 0.437 HD13 ' HA ' ' W' ' 26' ' ' LEU . 4.1 mm? 67.24 61.35 0.48 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 122.363 1.078 . . . . 0.0 110.919 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 27' ' ' GLU . . . . . 0.587 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 2.4 tt0 -112.99 160.79 17.75 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.622 -1.626 . . . . 0.0 109.465 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 28' ' ' SER . . . . . 0.556 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 34.4 m -114.45 147.4 39.34 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 122.05 -0.406 . . . . 0.0 111.404 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 29' ' ' THR . . . . . 0.629 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 3.2 p -143.45 137.21 28.43 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 30' ' ' TRP . . . . . 0.666 ' CD1' HG21 ' P' ' 105' ' ' ILE . 72.3 m95 -72.15 -61.88 1.63 Allowed 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.729 -0.607 . . . . 0.0 110.652 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 31' ' ' GLU . . . . . 0.525 ' OE1' ' HG2' ' W' ' 32' ' ' LYS . 3.0 pt-20 -105.63 -161.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 119.347 -0.941 . . . . 0.0 111.138 172.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 32' ' ' LYS . . . . . 0.525 ' HG2' ' OE1' ' W' ' 31' ' ' GLU . 9.8 ptpp? -61.42 139.54 94.86 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-O 121.983 0.897 . . . . 0.0 113.055 -167.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 33' ' ' PRO . . . . . 0.65 ' HD2' HD23 ' W' ' 36' ' ' LEU . 71.5 Cg_exo -64.53 -178.62 0.71 Allowed 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 124.41 3.407 . . . . 0.0 114.116 172.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -51.36 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.57 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -94.5 3.46 55.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.452 -172.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' W' W ' 36' ' ' LEU . . . . . 0.65 HD23 ' HD2' ' W' ' 33' ' ' PRO . 6.5 tp -87.63 95.19 9.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.68 0.753 . . . . 0.0 109.775 177.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 pttm . . . . . 0 C--O 1.244 0.783 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.726 179.962 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' P' P ' 101' ' ' PRO . . . . . 0.43 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 7.2 Cg_exo . . . . . 0 N--CA 1.481 0.737 0 N-CA-C 109.992 -0.811 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' P' P ' 102' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.51 148.99 23.79 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.38 2.053 . . . . 0.0 111.98 -177.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 103' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.1 Cg_exo -78.12 148.51 24.54 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.852 2.368 . . . . 0.0 112.379 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.7 148.76 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 169.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' P' P ' 105' ' ' ILE . . . . . 0.666 HG21 ' CD1' ' W' ' 30' ' ' TRP . 2.0 mp -77.88 148.97 76.53 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 106' ' ' PRO . . . . . 0.66 ' O ' HG22 ' P' ' 105' ' ' ILE . 73.2 Cg_endo -78.34 148.81 24.13 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 121.614 1.542 . . . . 0.0 109.614 166.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 107' ' ' PRO . . . . . 0.523 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 73.7 Cg_endo -78.39 149.12 24.25 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.332 1.355 . . . . 0.0 113.14 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' P' P ' 108' ' ' PRO . . . . . 0.523 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 3.8 Cg_exo . . . . . 0 N--CA 1.463 -0.281 0 C-N-CA 123.055 2.503 . . . . 0.0 111.601 172.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 6' ' ' SER . . . . . 0.533 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 33.1 t . . . . . 0 CA--C 1.51 -0.561 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 7' ' ' GLU . . . . . 0.545 ' OE1' ' HD2' ' W' ' 24' ' ' ARG . 27.7 mt-10 63.0 79.89 0.25 Allowed 'General case' 0 N--CA 1.444 -0.725 0 CA-C-O 122.173 0.987 . . . . 0.0 108.808 -176.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 8' ' ' TRP . . . . . 0.647 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 36.0 m95 -124.08 124.73 43.17 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.833 -172.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 9' ' ' THR . . . . . 0.688 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.2 OUTLIER -112.43 176.84 4.85 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-O 122.117 0.961 . . . . 0.0 111.13 174.844 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' W' W ' 10' ' ' GLU . . . . . 0.487 ' N ' ' OG1' ' W' ' 9' ' ' THR . 43.3 mt-10 -111.95 118.9 36.76 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.822 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -123.96 119.12 28.66 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.837 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 12' ' ' LYS . . . . . 0.585 ' H ' ' HD2' ' W' ' 12' ' ' LYS . 0.0 OUTLIER -104.18 123.68 47.74 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.766 176.86 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 10.8 p -82.21 177.0 9.03 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.0 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.87 -26.86 62.67 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -175.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 15' ' ' ASP . . . . . 0.409 ' OD2' ' HG2' ' W' ' 17' ' ' LYS . 19.1 t70 -76.83 -28.16 55.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.499 -178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.78 29.27 5.34 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.299 -0.721 . . . . 0.0 111.299 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 17' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 40.9 mmtm -96.74 123.34 40.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.468 -0.366 . . . . 0.0 110.402 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 51.9 m -86.53 106.37 17.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.357 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 19' ' ' TYR . . . . . 0.746 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 2.5 p90 -117.98 169.62 9.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.037 0.446 . . . . 0.0 110.306 175.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 20' ' ' TYR . . . . . 0.584 ' HB2' HG23 ' W' ' 29' ' ' THR . 34.9 m-85 -107.8 139.42 42.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.927 -177.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 21' ' ' TYR . . . . . 0.688 ' HB3' HG23 ' W' ' 9' ' ' THR . 58.6 t80 -116.98 99.12 6.86 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 -175.249 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 22' ' ' ASN . . . . . 0.647 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.9 t-20 -56.62 108.87 0.54 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.27 -177.28 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.97 4.44 50.08 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.02 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 24' ' ' ARG . . . . . 0.577 ' HB3' HD21 ' W' ' 22' ' ' ASN . 23.6 tpt180 -63.75 -63.67 1.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.697 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 16.6 p -130.44 20.84 5.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.267 177.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 67.1 85.36 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.279 -175.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 27' ' ' GLU . . . . . 0.51 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 7.0 tp10 -142.17 160.29 40.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.172 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 28' ' ' SER . . . . . 0.572 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 6.3 m -114.54 140.11 49.03 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.261 -0.274 . . . . 0.0 110.718 172.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 29' ' ' THR . . . . . 0.584 HG23 ' HB2' ' W' ' 20' ' ' TYR . 1.7 t -144.23 136.37 26.4 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.521 176.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 30' ' ' TRP . . . . . 0.746 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 89.9 m95 -69.88 -70.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.704 0.288 . . . . 0.0 110.822 -174.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mp0 -86.94 -177.15 5.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.27 0.557 . . . . 0.0 111.054 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 32' ' ' LYS . . . . . 0.498 ' HD2' ' HB2' ' W' ' 37' ' ' LYS . 25.3 pttm -69.62 147.39 96.55 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.678 -174.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 33' ' ' PRO . . . . . 0.652 ' HD2' HD23 ' W' ' 36' ' ' LEU . 53.4 Cg_exo -64.71 163.94 25.87 Favored 'Trans proline' 0 C--N 1.336 -0.113 0 C-N-CA 123.573 2.848 . . . . 0.0 113.003 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -71.31 -27.66 63.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.147 -175.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.09 -20.52 21.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.455 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 36' ' ' LEU . . . . . 0.652 HD23 ' HD2' ' W' ' 33' ' ' PRO . 9.7 tp -97.1 101.65 13.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.811 -173.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' W' W ' 37' ' ' LYS . . . . . 0.498 ' HB2' ' HD2' ' W' ' 32' ' ' LYS . 27.9 mtpp . . . . . 0 C--O 1.245 0.828 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.591 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' P' P ' 101' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 10.2 Cg_endo . . . . . 0 N--CA 1.478 0.604 0 N-CA-C 111.072 -0.396 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' P' P ' 102' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.3 Cg_exo -77.71 148.65 25.87 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.946 2.431 . . . . 0.0 111.06 176.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 103' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.63 148.56 26.04 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.377 2.052 . . . . 0.0 112.661 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.29 149.19 33.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.926 172.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' P' P ' 105' ' ' ILE . . . . . 0.667 HG21 ' CD1' ' W' ' 30' ' ' TRP . 1.8 mp -78.19 148.62 74.93 Favored Pre-proline 0 C--N 1.32 -0.684 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.298 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 106' ' ' PRO . . . . . 0.634 ' O ' HG22 ' P' ' 105' ' ' ILE . 73.0 Cg_endo -78.15 148.68 24.59 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.678 2.252 . . . . 0.0 111.126 164.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 107' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' P' ' 106' ' ' PRO . 4.4 Cg_exo -78.28 148.9 24.4 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.118 1.879 . . . . 0.0 111.093 171.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' P' P ' 108' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 2.8 Cg_exo . . . . . 0 N--CA 1.458 -0.614 0 C-N-CA 121.503 1.469 . . . . 0.0 111.383 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 6' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' W' ' 7' ' ' GLU . 18.5 t . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 7' ' ' GLU . . . . . 0.965 ' HB3' ' HB2' ' W' ' 23' ' ' ASN . 0.9 OUTLIER 74.51 79.04 0.11 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.381 1.051 . . . . 0.0 108.423 -171.64 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' W' W ' 8' ' ' TRP . . . . . 0.647 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 20.7 m95 -124.73 112.26 16.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 109.834 -172.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 9' ' ' THR . . . . . 0.934 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -100.01 167.41 10.51 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 122.331 1.062 . . . . 0.0 111.673 176.013 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' W' W ' 10' ' ' GLU . . . . . 0.412 ' H ' ' HG2' ' W' ' 10' ' ' GLU . 8.3 pt-20 -102.94 112.33 25.1 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 112.594 -2.094 . . . . 0.0 110.359 -176.058 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 11' ' ' TYR . . . . . 0.452 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 3.4 m-85 -124.01 110.15 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.009 -175.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -99.22 123.34 43.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.702 175.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 69.0 p -81.83 170.8 15.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.477 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -13.02 62.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -80.69 -16.7 53.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.654 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.8 13.72 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.06 -0.591 . . . . 0.0 111.744 -176.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -104.35 124.24 48.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.544 0.211 . . . . 0.0 110.805 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 87.7 m -87.04 103.57 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.72 175.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 19' ' ' TYR . . . . . 0.71 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 1.1 p90 -118.17 166.14 12.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.202 0.525 . . . . 0.0 110.653 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 20' ' ' TYR . . . . . 0.712 ' HB2' HG23 ' W' ' 29' ' ' THR . 35.8 m-85 -107.92 144.61 34.94 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.313 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 21' ' ' TYR . . . . . 0.934 ' HB3' HG23 ' W' ' 9' ' ' THR . 50.9 t80 -117.1 114.04 23.15 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 22' ' ' ASN . . . . . 0.956 HD22 ' HE ' ' W' ' 24' ' ' ARG . 17.6 t-20 -74.68 101.95 4.44 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.767 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 23' ' ' ASN . . . . . 0.965 ' HB2' ' HB3' ' W' ' 7' ' ' GLU . 79.1 m-20 -80.81 -10.03 59.76 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 24' ' ' ARG . . . . . 0.956 ' HE ' HD22 ' W' ' 22' ' ' ASN . 15.4 ttp180 -49.9 -59.51 3.79 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.125 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 25' ' ' THR . . . . . 0.445 HG23 ' HG2' ' W' ' 24' ' ' ARG . 8.8 p -132.12 17.66 4.55 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.2 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 62.79 81.86 0.19 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.005 -172.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 27' ' ' GLU . . . . . 0.619 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.4 tp10 -142.03 167.53 21.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.54 -178.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 28' ' ' SER . . . . . 0.606 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -114.58 143.48 44.93 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 172.186 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' W' W ' 29' ' ' THR . . . . . 0.712 HG23 ' HB2' ' W' ' 20' ' ' TYR . 1.5 t -144.05 137.08 27.37 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 173.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 30' ' ' TRP . . . . . 0.71 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 92.4 m95 -69.89 -82.14 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.661 0.267 . . . . 0.0 111.464 -174.242 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -105.24 -155.79 0.55 Allowed 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.897 -172.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -53.12 115.82 8.21 Favored Pre-proline 0 N--CA 1.464 0.243 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -168.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 33' ' ' PRO . . . . . 0.467 ' HB2' ' HB3' ' W' ' 36' ' ' LEU . 36.5 Cg_exo -65.09 148.31 89.2 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 123.203 2.602 . . . . 0.0 111.286 169.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.63 -37.93 68.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.452 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -94.84 24.82 4.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.001 0.429 . . . . 0.0 111.174 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' W' W ' 36' ' ' LEU . . . . . 0.586 HD22 ' CD1' ' W' ' 8' ' ' TRP . 34.8 tp -156.45 43.2 0.39 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.011 0.91 . . . . 0.0 108.811 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.597 -179.269 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' P' P ' 101' ' ' PRO . . . . . 0.497 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 1.7 Cg_endo . . . . . 0 N--CA 1.474 0.377 0 N-CA-C 110.187 -0.736 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' P' P ' 102' ' ' PRO . . . . . 0.497 ' HD3' ' HA ' ' P' ' 101' ' ' PRO . 4.9 Cg_exo -78.06 148.95 25.09 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.928 2.419 . . . . 0.0 111.99 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 103' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.94 148.68 25.23 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.545 2.163 . . . . 0.0 111.629 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 104' ' ' LEU . . . . . 0.444 ' O ' HD12 ' P' ' 104' ' ' LEU . 3.5 pp -78.05 148.91 34.08 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.367 173.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 105' ' ' ILE . . . . . 0.624 HG22 ' O ' ' P' ' 106' ' ' PRO . 1.7 mp -78.45 148.81 74.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 106' ' ' PRO . . . . . 0.624 ' O ' HG22 ' P' ' 105' ' ' ILE . 60.2 Cg_endo -78.14 148.88 24.79 Favored 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.07 1.846 . . . . 0.0 110.682 162.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 107' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 72.6 Cg_endo -77.95 149.14 25.6 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.625 1.55 . . . . 0.0 112.111 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' P' P ' 108' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 5.6 Cg_exo . . . . . 0 N--CA 1.458 -0.597 0 C-N-CA 122.298 1.998 . . . . 0.0 112.106 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 6' ' ' SER . . . . . 0.767 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.1 t . . . . . 0 N--CA 1.446 -0.658 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 7' ' ' GLU . . . . . 0.417 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 6.2 mm-40 61.77 77.73 0.32 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -168.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 8' ' ' TRP . . . . . 0.786 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 45.1 m95 -124.19 124.74 43.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.464 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 9' ' ' THR . . . . . 0.679 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -108.62 167.99 9.65 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-O 122.651 1.215 . . . . 0.0 111.89 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' W' W ' 10' ' ' GLU . . . . . 0.495 ' CD ' ' H ' ' W' ' 10' ' ' GLU . 0.7 OUTLIER -106.54 115.99 31.16 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 111.838 -2.437 . . . . 0.0 110.455 -177.825 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -124.08 116.03 22.12 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.537 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 12' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' W' ' 17' ' ' LYS . 48.5 mtmt -103.69 113.24 26.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 77.2 p -79.92 173.98 12.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.161 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.88 -6.0 38.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.543 . . . . 0.0 111.102 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -84.99 -3.66 58.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.766 178.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.8 28.24 55.09 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 17' ' ' LYS . . . . . 0.44 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.3 mmtm -105.94 126.44 52.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.761 -175.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 95.8 m -88.3 101.84 14.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.041 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 19' ' ' TYR . . . . . 0.652 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.5 OUTLIER -115.64 163.52 15.68 Favored 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.377 178.406 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' W' W ' 20' ' ' TYR . . . . . 0.633 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 26.9 m-85 -107.81 143.11 36.85 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 121.454 0.645 . . . . 0.0 109.763 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 21' ' ' TYR . . . . . 0.679 ' HB3' HG23 ' W' ' 9' ' ' THR . 58.1 t80 -117.24 100.94 8.04 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 22' ' ' ASN . . . . . 0.786 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 3.8 t-20 -55.28 111.92 0.98 Allowed 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.52 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 23' ' ' ASN . . . . . 0.417 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 54.2 t30 -98.52 5.02 48.27 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.054 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -61.33 -65.51 0.68 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.16 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 25' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' W' ' 26' ' ' LEU . 8.8 t -132.16 18.18 4.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.089 177.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 26' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' W' ' 25' ' ' THR . 4.3 mm? 71.06 85.04 0.13 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.221 -177.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 27' ' ' GLU . . . . . 0.518 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 1.6 tt0 -141.66 161.24 38.41 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.224 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 28' ' ' SER . . . . . 0.483 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 31.2 m -114.4 146.41 40.62 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 121.836 -0.54 . . . . 0.0 111.017 174.222 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 29' ' ' THR . . . . . 0.633 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 4.3 p -143.35 134.34 25.55 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 30' ' ' TRP . . . . . 0.652 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 80.6 m95 -69.76 -64.69 0.83 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.577 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -105.37 -164.4 1.03 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 32' ' ' LYS . . . . . 0.887 ' HD3' ' HA ' ' W' ' 37' ' ' LYS . 56.6 mttp -52.91 132.61 48.74 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 33' ' ' PRO . . . . . 0.507 ' HG2' HD23 ' W' ' 36' ' ' LEU . 35.8 Cg_exo -65.33 -159.78 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.497 3.464 . . . . 0.0 113.916 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -78.69 -68.04 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.178 -173.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -85.0 -8.55 58.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.176 0.512 . . . . 0.0 110.865 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' W' W ' 36' ' ' LEU . . . . . 0.507 HD23 ' HG2' ' W' ' 33' ' ' PRO . 38.0 tp -98.79 98.71 9.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.871 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' W' W ' 37' ' ' LYS . . . . . 0.887 ' HA ' ' HD3' ' W' ' 32' ' ' LYS . 62.6 pttt . . . . . 0 C--O 1.246 0.88 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.202 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 101' ' ' PRO . . . . . 0.417 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 2.5 Cg_endo . . . . . 0 N--CA 1.476 0.485 0 N-CA-C 110.092 -0.772 . . . . 0.0 110.092 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 102' ' ' PRO . . . . . 0.459 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.27 149.14 24.61 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.63 2.22 . . . . 0.0 112.382 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 103' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.7 Cg_exo -78.0 148.87 25.21 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.244 2.629 . . . . 0.0 111.277 174.032 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 86.3 mt -78.09 149.09 33.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.016 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' P' P ' 105' ' ' ILE . . . . . 0.651 HG21 ' CD1' ' W' ' 30' ' ' TRP . 1.5 mp -78.52 148.55 73.68 Favored Pre-proline 0 C--N 1.326 -0.431 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.381 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 106' ' ' PRO . . . . . 0.637 ' O ' HG22 ' P' ' 105' ' ' ILE . 72.0 Cg_endo -77.78 148.59 25.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.927 1.752 . . . . 0.0 110.078 164.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 107' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 72.7 Cg_endo -78.25 148.9 24.49 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.644 1.563 . . . . 0.0 112.468 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' P' P ' 108' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 5.2 Cg_exo . . . . . 0 N--CA 1.459 -0.519 0 C-N-CA 122.894 2.396 . . . . 0.0 111.342 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 6' ' ' SER . . . . . 0.461 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 9.3 t . . . . . 0 N--CA 1.45 -0.447 0 CA-C-O 121.042 0.449 . . . . 0.0 110.883 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 68.6 83.91 0.16 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.422 1.106 . . . . 0.0 109.314 -169.055 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 8' ' ' TRP . . . . . 0.726 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 49.0 m95 -124.94 114.87 19.73 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.729 -1.578 . . . . 0.0 108.662 -175.334 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 9' ' ' THR . . . . . 0.625 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -99.93 173.58 6.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.94 0.876 . . . . 0.0 112.056 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' W' W ' 10' ' ' GLU . . . . . 0.454 ' N ' ' OG1' ' W' ' 9' ' ' THR . 37.9 mt-10 -106.84 117.04 33.0 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 113.786 -1.552 . . . . 0.0 110.111 -176.188 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -127.02 106.69 9.45 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.686 -179.14 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -90.15 113.4 25.16 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.921 175.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.9 p -75.37 161.47 29.23 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.29 -19.8 64.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -65.67 -37.99 88.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.003 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.17 36.68 1.45 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.806 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -119.48 135.31 54.82 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 37.4 m -86.9 101.67 13.62 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 19' ' ' TYR . . . . . 0.77 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.15 162.41 18.27 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.615 178.279 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' W' W ' 20' ' ' TYR . . . . . 0.801 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 54.1 m-85 -107.71 150.62 26.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.209 -175.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 21' ' ' TYR . . . . . 0.625 ' HB3' HG23 ' W' ' 9' ' ' THR . 48.3 t80 -117.31 96.38 5.39 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.074 0.94 . . . . 0.0 108.49 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 22' ' ' ASN . . . . . 1.022 HD22 ' HB2' ' W' ' 24' ' ' ARG . 8.8 t-20 -55.01 120.2 6.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.027 -1.897 . . . . 0.0 111.198 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -89.45 -12.79 39.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 24' ' ' ARG . . . . . 1.022 ' HB2' HD22 ' W' ' 22' ' ' ASN . 33.3 mtp180 -45.92 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 14.9 t -110.98 25.16 12.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.118 175.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 26' ' ' LEU . . . . . 0.406 ' HA ' HD22 ' W' ' 26' ' ' LEU . 0.6 OUTLIER 63.8 86.69 0.12 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.171 -173.881 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' W' W ' 27' ' ' GLU . . . . . 0.524 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 8.4 tp10 -142.26 165.1 28.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.46 -174.091 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 28' ' ' SER . . . . . 0.604 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 4.3 m -114.53 152.46 31.7 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.622 171.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 29' ' ' THR . . . . . 0.801 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 45.7 p -143.9 135.11 25.67 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 30' ' ' TRP . . . . . 0.812 ' CH2' HD13 ' P' ' 105' ' ' ILE . 77.7 m95 -69.81 -65.86 0.66 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 118.293 0.497 . . . . 0.0 110.821 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -105.33 -175.52 2.82 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.959 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 32' ' ' LYS . . . . . 0.419 ' HG3' ' HB3' ' W' ' 36' ' ' LEU . 38.5 ttmt -62.74 128.9 92.48 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.636 -174.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 33' ' ' PRO . . . . . 0.624 ' HD2' HD12 ' W' ' 36' ' ' LEU . 50.2 Cg_exo -64.82 153.85 75.83 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.706 2.937 . . . . 0.0 112.509 171.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -63.83 -30.94 71.98 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.264 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' W' W ' 35' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' W' ' 35' ' ' GLU . 5.6 pt-20 -85.8 6.95 25.75 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.425 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' W' W ' 36' ' ' LEU . . . . . 0.666 ' HG ' ' CD1' ' W' ' 8' ' ' TRP . 1.0 OUTLIER -103.68 110.96 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' W' W ' 37' ' ' LYS . . . . . 0.494 ' H ' ' HG3' ' W' ' 37' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.281 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.479 0.664 0 N-CA-C 110.535 -0.602 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' P' P ' 102' ' ' PRO . . . . . 0.463 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 6.0 Cg_exo -78.31 149.07 24.43 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.964 2.443 . . . . 0.0 111.249 173.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 103' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.0 Cg_exo -77.87 148.83 25.57 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.21 1.94 . . . . 0.0 111.57 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 56.1 tp -78.08 148.77 34.09 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' P' P ' 105' ' ' ILE . . . . . 0.826 HD12 ' H ' ' P' ' 105' ' ' ILE . 1.1 mp -78.31 148.95 75.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.515 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 106' ' ' PRO . . . . . 0.604 ' CD ' ' HB2' ' W' ' 28' ' ' SER . 73.0 Cg_endo -78.18 148.86 24.65 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.195 2.597 . . . . 0.0 109.663 160.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 107' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' P' ' 106' ' ' PRO . 3.2 Cg_exo -77.98 148.76 25.17 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.021 1.148 . . . . 0.0 111.535 177.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 C--N 1.345 0.387 0 C-N-CA 122.461 2.107 . . . . 0.0 112.717 179.7 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.13 145.41 53.38 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.899 0.38 . . . . 0.0 110.393 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 7.0 p -86.61 101.97 13.74 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.109 0.481 . . . . 0.0 110.07 177.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.28 145.44 55.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.813 -174.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 4.5 m -82.62 116.52 26.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.297 0.57 . . . . 0.0 110.546 175.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' W' W ' 6' ' ' SER . . . . . 0.439 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.7 t -169.9 -148.2 0.06 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.201 -0.908 . . . . 0.0 108.71 -175.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 7' ' ' GLU . . . . . 0.729 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 35.8 mt-10 71.8 77.81 0.16 Allowed 'General case' 0 C--N 1.322 -0.622 0 O-C-N 124.472 1.108 . . . . 0.0 108.721 -178.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 8' ' ' TRP . . . . . 0.696 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 27.4 m95 -124.5 111.55 15.83 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.897 -173.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 9' ' ' THR . . . . . 0.521 HG23 ' HB3' ' W' ' 21' ' ' TYR . 2.2 t -99.69 -174.4 2.7 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 122.413 1.101 . . . . 0.0 110.468 177.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 10' ' ' GLU . . . . . 0.515 ' N ' ' OG1' ' W' ' 9' ' ' THR . 16.7 mt-10 -110.99 122.28 47.48 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.846 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 11' ' ' TYR . . . . . 0.543 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 1.9 m-85 -128.83 115.59 18.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.407 0.623 . . . . 0.0 110.046 175.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -96.9 120.63 37.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.067 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' W' W ' 13' ' ' THR . . . . . 0.412 ' OG1' ' HB3' ' W' ' 17' ' ' LYS . 16.4 p -90.71 165.66 13.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.334 175.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -18.4 61.38 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -171.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' W' W ' 15' ' ' ASP . . . . . 0.448 ' OD2' ' HB2' ' W' ' 17' ' ' LYS . 6.3 p-10 -84.73 -3.19 58.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 110.954 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.39 17.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.881 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' W' W ' 17' ' ' LYS . . . . . 0.448 ' HB2' ' OD2' ' W' ' 15' ' ' ASP . 14.7 tppt? -97.86 130.21 44.78 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -177.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.7 94.06 9.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' W' W ' 19' ' ' TYR . . . . . 0.625 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.0 OUTLIER -108.11 157.58 18.15 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.748 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' W' W ' 20' ' ' TYR . . . . . 0.699 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 85.5 m-85 -107.98 145.55 33.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.556 0.693 . . . . 0.0 110.232 -173.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 21' ' ' TYR . . . . . 0.521 ' HB3' HG23 ' W' ' 9' ' ' THR . 40.8 t80 -117.53 101.71 8.59 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 22' ' ' ASN . . . . . 0.696 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.3 t-20 -56.92 113.83 1.84 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 113.602 -1.636 . . . . 0.0 110.434 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 23' ' ' ASN . . . . . 0.729 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 5.9 t30 -92.28 -7.28 48.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 24' ' ' ARG . . . . . 0.45 ' HB3' HD21 ' W' ' 22' ' ' ASN . 0.5 OUTLIER -54.89 -60.63 3.1 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.226 -176.369 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' W' W ' 25' ' ' THR . . . . . 0.411 HG23 ' HD2' ' W' ' 24' ' ' ARG . 10.1 p -132.24 20.73 4.42 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.393 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 26' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' W' ' 26' ' ' LEU . 0.5 OUTLIER 65.1 81.92 0.2 Allowed 'General case' 0 CA--C 1.531 0.233 0 O-C-N 123.79 0.681 . . . . 0.0 110.265 -174.919 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' W' W ' 27' ' ' GLU . . . . . 0.477 ' HB3' ' CB ' ' W' ' 22' ' ' ASN . 9.9 tp10 -141.96 166.37 24.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.047 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 28' ' ' SER . . . . . 0.477 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -114.35 149.83 35.49 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 122.077 -0.389 . . . . 0.0 111.008 174.648 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' W' W ' 29' ' ' THR . . . . . 0.699 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 15.0 p -143.43 138.53 29.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 172.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 30' ' ' TRP . . . . . 0.625 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 90.4 m95 -70.21 -70.78 0.27 Allowed 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.682 178.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.0 -160.65 0.77 Allowed 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.88 -179.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 32' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' W' ' 33' ' ' PRO . 97.3 mttt -57.39 128.68 79.26 Favored Pre-proline 0 C--O 1.231 0.117 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 33' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' W' ' 36' ' ' LEU . 74.3 Cg_exo -64.59 -178.82 0.76 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.51 3.474 . . . . 0.0 113.594 170.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -72.23 -52.29 17.11 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.426 -177.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -80.0 -23.48 41.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 111.372 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' W' W ' 36' ' ' LEU . . . . . 0.558 HD22 ' CD1' ' W' ' 8' ' ' TRP . 12.8 tp -84.87 101.45 12.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.564 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 46.9 mttp . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.692 -167.89 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo . . . . . 0 N--CA 1.481 0.783 0 N-CA-C 109.464 -1.014 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' P' P ' 102' ' ' PRO . . . . . 0.503 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 72.5 Cg_endo -77.99 148.66 25.05 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.51 1.473 . . . . 0.0 113.061 -177.032 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 103' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.6 Cg_exo -78.22 148.94 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.958 3.106 . . . . 0.0 111.543 171.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 104' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' P' ' 104' ' ' LEU . 4.3 mm? -78.12 148.63 34.09 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 167.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 105' ' ' ILE . . . . . 0.704 HG22 ' O ' ' P' ' 106' ' ' PRO . 2.0 mp -78.48 148.56 73.82 Favored Pre-proline 0 C--N 1.322 -0.592 0 C-N-CA 120.333 -0.547 . . . . 0.0 109.681 176.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.704 ' O ' HG22 ' P' ' 105' ' ' ILE . 71.7 Cg_endo -78.16 148.69 24.57 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 121.825 1.683 . . . . 0.0 110.396 163.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 107' ' ' PRO . . . . . 0.489 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 5.7 Cg_exo -78.07 148.84 24.98 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.163 1.242 . . . . 0.0 111.878 177.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 108' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 2.8 Cg_exo -78.1 149.06 25.1 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.731 2.288 . . . . 0.0 111.083 171.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 109' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 4.1 Cg_exo . . . . . 0 C--O 1.247 0.947 0 C-N-CA 122.705 2.27 . . . . 0.0 111.69 176.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.141 -0.384 . . . . 0.0 112.141 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.99 177.67 7.62 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.743 -0.269 . . . . 0.0 110.793 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 6.8 p -123.09 160.46 26.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.761 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -83.32 96.21 8.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.731 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 14.9 m -107.5 92.23 2.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.389 0.614 . . . . 0.0 110.899 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 6' ' ' SER . . . . . . . . . . . . . 21.3 t 178.12 -149.77 0.01 OUTLIER 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.391 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 7' ' ' GLU . . . . . 0.406 ' HB3' ' HB2' ' W' ' 23' ' ' ASN . 46.2 mt-10 72.85 85.26 0.12 Allowed 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 124.637 1.21 . . . . 0.0 109.538 -176.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 8' ' ' TRP . . . . . 0.555 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 47.3 m95 -124.29 134.89 53.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 113.745 -1.57 . . . . 0.0 110.041 -176.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 9' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 1.5 t -121.32 -179.19 3.99 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 122.414 1.102 . . . . 0.0 110.702 174.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 10' ' ' GLU . . . . . 0.497 ' N ' ' OG1' ' W' ' 9' ' ' THR . 38.4 mt-10 -112.05 119.46 38.54 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 112.515 -2.13 . . . . 0.0 109.492 -178.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -123.73 88.59 2.94 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.817 0.817 . . . . 0.0 109.554 175.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -80.24 107.3 12.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.887 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 70.8 p -74.86 173.61 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.054 0.454 . . . . 0.0 111.78 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.5 -18.08 64.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.996 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.4 -23.09 62.7 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.883 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.18 29.93 10.77 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.668 -175.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 37.1 tptt -107.19 131.98 53.56 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 -176.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.2 m -87.41 97.97 11.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.701 0.286 . . . . 0.0 110.37 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 19' ' ' TYR . . . . . 0.608 ' CD2' HD11 ' P' ' 105' ' ' ILE . 0.2 OUTLIER -118.31 161.87 19.21 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.102 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' W' W ' 20' ' ' TYR . . . . . 0.681 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 52.8 m-85 -107.66 144.5 34.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.99 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 21' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -117.16 126.17 52.38 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 22' ' ' ASN . . . . . 1.097 HD22 ' HB3' ' W' ' 24' ' ' ARG . 37.2 t30 -91.17 120.62 32.26 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.024 -1.444 . . . . 0.0 111.396 -170.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 23' ' ' ASN . . . . . 0.406 ' HB2' ' HB3' ' W' ' 7' ' ' GLU . 19.5 m120 -91.58 2.41 56.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.868 172.081 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 24' ' ' ARG . . . . . 1.097 ' HB3' HD22 ' W' ' 22' ' ' ASN . 60.9 ttt180 -59.94 -68.3 0.3 Allowed 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.664 0.745 . . . . 0.0 110.573 -178.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 25' ' ' THR . . . . . 0.618 HG23 ' HG2' ' W' ' 24' ' ' ARG . 21.9 p -126.47 21.66 7.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.577 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 63.92 76.03 0.37 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.117 -173.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 27' ' ' GLU . . . . . 0.829 ' HB3' HD21 ' W' ' 22' ' ' ASN . 5.5 tp10 -127.76 159.0 36.13 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.457 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 28' ' ' SER . . . . . 0.646 ' HB3' HG23 ' P' ' 105' ' ' ILE . 0.1 OUTLIER -114.59 151.46 33.41 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 171.41 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' W' W ' 29' ' ' THR . . . . . 0.681 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 11.3 p -143.55 131.25 21.33 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 30' ' ' TRP . . . . . 0.568 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 94.7 m95 -69.92 -50.49 41.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 0.0 110.222 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -105.41 -167.97 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.001 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -77.81 140.38 62.95 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.448 -174.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 33' ' ' PRO . . . . . 0.953 ' HD2' HD23 ' W' ' 36' ' ' LEU . 54.0 Cg_exo -64.35 161.5 34.28 Favored 'Trans proline' 0 N--CA 1.474 0.364 0 C-N-CA 123.383 2.722 . . . . 0.0 112.231 170.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -95.82 -17.82 20.86 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.028 0.442 . . . . 0.0 110.568 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' W' W ' 35' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' W' ' 35' ' ' GLU . 4.3 pt-20 -80.93 -9.71 59.8 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.714 0.768 . . . . 0.0 109.038 170.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 36' ' ' LEU . . . . . 0.953 HD23 ' HD2' ' W' ' 33' ' ' PRO . 24.2 tp -101.88 113.25 26.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.978 174.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.436 -0.792 . . . . 0.0 110.42 -173.667 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo . . . . . 0 N--CA 1.477 0.512 0 N-CA-C 109.602 -0.961 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' P' P ' 102' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.3 Cg_endo -78.02 148.94 25.21 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.393 2.062 . . . . 0.0 111.987 177.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 103' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.4 Cg_exo -78.12 148.57 24.58 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.01 177.14 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 104' ' ' LEU . . . . . 0.687 ' H ' HD23 ' P' ' 104' ' ' LEU . 2.4 pt? -77.91 148.79 34.39 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 173.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 105' ' ' ILE . . . . . 0.646 HG23 ' HB3' ' W' ' 28' ' ' SER . 2.0 mp -78.34 148.78 74.7 Favored Pre-proline 0 C--N 1.319 -0.738 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 170.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.623 ' O ' HG22 ' P' ' 105' ' ' ILE . 72.4 Cg_endo -78.19 148.92 24.68 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 121.176 1.25 . . . . 0.0 110.477 163.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.38 149.15 24.29 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.334 2.023 . . . . 0.0 111.544 172.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' P' P ' 108' ' ' PRO . . . . . 0.485 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 73.9 Cg_endo -77.75 148.95 26.04 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.877 1.718 . . . . 0.0 111.167 177.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 109' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 6.1 Cg_exo . . . . . 0 C--O 1.246 0.893 0 C-N-CA 122.794 2.329 . . . . 0.0 112.032 -174.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.768 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . 70.43 93.52 0.08 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.486 0.66 . . . . 0.0 110.714 -177.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 31.4 p -86.34 22.71 1.75 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.304 -174.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.09 104.05 6.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.987 0.423 . . . . 0.0 111.534 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 59.3 t -99.48 90.64 2.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 6' ' ' SER . . . . . 0.535 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 96.9 p -169.57 -157.15 0.16 Allowed 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 -175.254 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 73.68 77.79 0.13 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -172.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 8' ' ' TRP . . . . . 0.623 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 43.5 m95 -124.03 125.94 45.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.282 -174.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 9' ' ' THR . . . . . 0.478 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 9.9 t -115.98 -171.63 2.02 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.617 1.199 . . . . 0.0 110.513 173.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 10' ' ' GLU . . . . . 0.606 ' HB3' ' HE3' ' W' ' 12' ' ' LYS . 40.4 mt-10 -112.33 122.13 46.84 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.372 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -127.37 107.22 9.78 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.417 0.627 . . . . 0.0 110.396 176.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 12' ' ' LYS . . . . . 0.606 ' HE3' ' HB3' ' W' ' 10' ' ' GLU . 0.0 OUTLIER -100.61 118.39 36.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.327 -178.799 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.6 p -75.0 168.24 20.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.673 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.42 -23.76 66.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.307 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -85.14 -10.63 56.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.441 178.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.86 58.81 1.15 Allowed Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.007 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 17' ' ' LYS . . . . . 0.58 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.7 mmtm -119.14 144.0 46.89 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.9 m -99.34 95.71 7.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.275 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 19' ' ' TYR . . . . . 0.742 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.35 165.69 13.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.915 175.768 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' W' W ' 20' ' ' TYR . . . . . 0.623 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 42.2 m-85 -107.67 144.69 34.39 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.261 0.553 . . . . 0.0 109.822 -175.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 21' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -117.3 99.34 6.95 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.337 1.065 . . . . 0.0 108.44 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 22' ' ' ASN . . . . . 0.886 ' ND2' ' HE ' ' W' ' 24' ' ' ARG . 17.7 t-20 -57.17 101.65 0.07 Allowed 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 112.737 -2.029 . . . . 0.0 110.944 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -84.31 -1.52 55.5 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 24' ' ' ARG . . . . . 0.886 ' HE ' ' ND2' ' W' ' 22' ' ' ASN . 19.7 ttp180 -56.36 -61.41 2.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.893 177.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 5.2 p -132.4 19.35 4.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.612 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 26' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' W' ' 26' ' ' LEU . 0.5 OUTLIER 63.96 81.82 0.2 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.527 0.68 . . . . 0.0 109.8 -173.268 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' W' W ' 27' ' ' GLU . . . . . 0.587 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.2 tp10 -142.3 165.64 26.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.215 -178.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 28' ' ' SER . . . . . 0.552 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 14.8 m -114.75 151.92 32.93 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.523 0.201 . . . . 0.0 111.535 173.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 29' ' ' THR . . . . . 0.623 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 10.5 p -143.84 137.02 27.65 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 172.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 30' ' ' TRP . . . . . 0.795 ' CH2' HD13 ' P' ' 105' ' ' ILE . 80.1 m95 -69.84 -57.99 4.41 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 121.774 -0.579 . . . . 0.0 110.459 176.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -105.17 -174.06 2.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.994 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 32' ' ' LYS . . . . . 0.476 ' HD3' ' OXT' ' W' ' 37' ' ' LYS . 60.3 mttp -52.74 142.46 33.06 Favored Pre-proline 0 C--O 1.238 0.493 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.751 -178.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 33' ' ' PRO . . . . . 0.509 ' HG2' HD23 ' W' ' 36' ' ' LEU . 46.1 Cg_exo -64.84 -165.79 0.08 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.013 3.142 . . . . 0.0 113.256 171.89 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -92.61 -40.76 10.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.569 -172.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' W' W ' 35' ' ' GLU . . . . . 0.415 ' H ' ' CD ' ' W' ' 35' ' ' GLU . 0.0 OUTLIER -97.22 -28.3 14.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.025 178.663 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' W' W ' 36' ' ' LEU . . . . . 0.509 HD23 ' HG2' ' W' ' 33' ' ' PRO . 24.7 tp -77.25 84.91 3.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.405 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' W' W ' 37' ' ' LYS . . . . . 0.476 ' OXT' ' HD3' ' W' ' 32' ' ' LYS . 56.1 mttp . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.101 174.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo . . . . . 0 N--CA 1.479 0.653 0 N-CA-C 110.205 -0.729 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' P' P ' 102' ' ' PRO . . . . . 0.514 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.9 Cg_endo -77.82 148.74 25.62 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.44 2.093 . . . . 0.0 112.239 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 103' ' ' PRO . . . . . 0.514 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 9.9 Cg_exo -77.69 148.87 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 123.422 2.748 . . . . 0.0 111.637 174.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 82.1 mt -78.28 148.98 33.64 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 105' ' ' ILE . . . . . 0.795 HD13 ' CH2' ' W' ' 30' ' ' TRP . 2.1 mp -77.87 148.97 76.6 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 120.251 -0.579 . . . . 0.0 109.513 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.552 ' CD ' ' HB2' ' W' ' 28' ' ' SER . 72.1 Cg_endo -78.13 148.6 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.698 1.599 . . . . 0.0 109.944 165.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.32 148.94 24.32 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.609 2.206 . . . . 0.0 112.872 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 108' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 74.3 Cg_endo -77.95 148.79 25.29 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.025 1.817 . . . . 0.0 109.617 166.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 109' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 6.0 Cg_exo . . . . . 0 C--O 1.246 0.88 0 C-N-CA 122.4 2.067 . . . . 0.0 112.729 -178.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.937 -0.465 . . . . 0.0 111.937 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.27 -18.27 13.63 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.063 0.458 . . . . 0.0 109.942 173.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 14.7 t -155.86 165.83 35.3 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . 66.92 175.62 0.25 Allowed 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.723 0.639 . . . . 0.0 111.435 -176.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 17.5 t 54.61 64.72 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.473 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 6' ' ' SER . . . . . 0.544 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 52.8 m -169.12 -171.64 1.35 Allowed 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 -177.567 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 7' ' ' GLU . . . . . 0.666 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 39.6 mm-40 67.77 80.45 0.21 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -170.392 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 8' ' ' TRP . . . . . 0.804 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 25.2 m95 -124.61 111.24 15.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.716 -170.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 9' ' ' THR . . . . . 0.476 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 0.6 OUTLIER -99.91 172.39 7.26 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.812 1.291 . . . . 0.0 111.5 175.814 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' W' W ' 10' ' ' GLU . . . . . 0.476 ' N ' ' OG1' ' W' ' 9' ' ' THR . 8.4 pt-20 -108.57 119.89 40.83 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 112.012 -2.358 . . . . 0.0 110.225 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -124.48 105.34 9.32 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.527 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.13 115.15 25.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.575 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -79.83 170.24 16.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.736 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.78 -16.84 62.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.779 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -84.94 0.18 52.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.259 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.86 26.35 60.65 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.001 -0.619 . . . . 0.0 111.71 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -105.47 124.95 50.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 91.9 m -86.91 106.34 17.71 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 19' ' ' TYR . . . . . 0.649 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.7 OUTLIER -109.59 163.91 13.02 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.588 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' W' W ' 20' ' ' TYR . . . . . 0.629 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 32.8 m-85 -107.67 141.55 39.0 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.366 0.603 . . . . 0.0 109.868 -176.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 21' ' ' TYR . . . . . 0.476 ' HB3' HG23 ' W' ' 9' ' ' THR . 51.7 t80 -117.39 94.72 4.66 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -177.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 22' ' ' ASN . . . . . 0.804 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 2.4 t-20 -51.19 109.04 0.29 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.056 -1.883 . . . . 0.0 110.461 -178.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 23' ' ' ASN . . . . . 0.666 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 65.0 t30 -91.7 5.8 48.34 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 174.374 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -64.61 0.86 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.269 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -131.93 17.3 4.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 -178.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 26' ' ' LEU . . . . . 0.437 HD13 ' HA ' ' W' ' 26' ' ' LEU . 4.1 mm? 67.24 61.35 0.48 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 122.363 1.078 . . . . 0.0 110.919 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 27' ' ' GLU . . . . . 0.587 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 2.4 tt0 -112.99 160.79 17.75 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.622 -1.626 . . . . 0.0 109.465 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 28' ' ' SER . . . . . 0.556 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 34.4 m -114.45 147.4 39.34 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 122.05 -0.406 . . . . 0.0 111.404 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 29' ' ' THR . . . . . 0.629 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 3.2 p -143.45 137.21 28.43 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 30' ' ' TRP . . . . . 0.666 ' CD1' HG21 ' P' ' 105' ' ' ILE . 72.3 m95 -72.15 -61.88 1.63 Allowed 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.729 -0.607 . . . . 0.0 110.652 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 31' ' ' GLU . . . . . 0.525 ' OE1' ' HG2' ' W' ' 32' ' ' LYS . 3.0 pt-20 -105.63 -161.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 119.347 -0.941 . . . . 0.0 111.138 172.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 32' ' ' LYS . . . . . 0.525 ' HG2' ' OE1' ' W' ' 31' ' ' GLU . 9.8 ptpp? -61.42 139.54 94.86 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-O 121.983 0.897 . . . . 0.0 113.055 -167.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 33' ' ' PRO . . . . . 0.65 ' HD2' HD23 ' W' ' 36' ' ' LEU . 71.5 Cg_exo -64.53 -178.62 0.71 Allowed 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 124.41 3.407 . . . . 0.0 114.116 172.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -51.36 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.57 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -94.5 3.46 55.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.452 -172.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' W' W ' 36' ' ' LEU . . . . . 0.65 HD23 ' HD2' ' W' ' 33' ' ' PRO . 6.5 tp -87.63 95.19 9.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.68 0.753 . . . . 0.0 109.775 177.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 pttm . . . . . 0 C--O 1.244 0.783 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.726 179.962 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' P' P ' 101' ' ' PRO . . . . . 0.43 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 7.2 Cg_exo . . . . . 0 N--CA 1.481 0.737 0 N-CA-C 109.992 -0.811 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 102' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.51 148.99 23.79 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.38 2.053 . . . . 0.0 111.98 -177.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 103' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.1 Cg_exo -78.12 148.51 24.54 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.852 2.368 . . . . 0.0 112.379 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.7 148.76 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 169.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' P' P ' 105' ' ' ILE . . . . . 0.666 HG21 ' CD1' ' W' ' 30' ' ' TRP . 2.0 mp -77.88 148.97 76.53 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.66 ' O ' HG22 ' P' ' 105' ' ' ILE . 73.2 Cg_endo -78.34 148.81 24.13 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 121.614 1.542 . . . . 0.0 109.614 166.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 107' ' ' PRO . . . . . 0.523 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 73.7 Cg_endo -78.39 149.12 24.25 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.332 1.355 . . . . 0.0 113.14 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 108' ' ' PRO . . . . . 0.523 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 3.8 Cg_exo -78.27 149.2 24.68 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.055 2.503 . . . . 0.0 111.601 172.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 109' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo . . . . . 0 C--O 1.25 1.111 0 C-N-CA 122.699 2.266 . . . . 0.0 111.369 175.831 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.821 0 N-CA-C 111.616 -0.594 . . . . 0.0 111.616 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.81 -26.72 11.64 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.814 0.34 . . . . 0.0 111.029 -177.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 9.7 t -83.36 125.73 31.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.27 0.557 . . . . 0.0 110.323 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.94 164.93 12.9 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.473 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 5' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' W' ' 6' ' ' SER . 28.8 m -126.74 160.73 34.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.696 -179.188 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 6' ' ' SER . . . . . 0.533 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 33.1 t 171.09 -153.69 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 7' ' ' GLU . . . . . 0.545 ' OE1' ' HD2' ' W' ' 24' ' ' ARG . 27.7 mt-10 63.0 79.89 0.25 Allowed 'General case' 0 N--CA 1.444 -0.725 0 CA-C-O 122.173 0.987 . . . . 0.0 108.808 -176.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 8' ' ' TRP . . . . . 0.647 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 36.0 m95 -124.08 124.73 43.17 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.833 -172.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 9' ' ' THR . . . . . 0.688 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.2 OUTLIER -112.43 176.84 4.85 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-O 122.117 0.961 . . . . 0.0 111.13 174.844 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' W' W ' 10' ' ' GLU . . . . . 0.487 ' N ' ' OG1' ' W' ' 9' ' ' THR . 43.3 mt-10 -111.95 118.9 36.76 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.822 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -123.96 119.12 28.66 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.837 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 12' ' ' LYS . . . . . 0.585 ' H ' ' HD2' ' W' ' 12' ' ' LYS . 0.0 OUTLIER -104.18 123.68 47.74 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.766 176.86 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 10.8 p -82.21 177.0 9.03 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.0 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.87 -26.86 62.67 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -175.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 15' ' ' ASP . . . . . 0.409 ' OD2' ' HG2' ' W' ' 17' ' ' LYS . 19.1 t70 -76.83 -28.16 55.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.499 -178.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.78 29.27 5.34 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.299 -0.721 . . . . 0.0 111.299 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 17' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 40.9 mmtm -96.74 123.34 40.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.468 -0.366 . . . . 0.0 110.402 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 51.9 m -86.53 106.37 17.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.357 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 19' ' ' TYR . . . . . 0.746 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 2.5 p90 -117.98 169.62 9.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.037 0.446 . . . . 0.0 110.306 175.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 20' ' ' TYR . . . . . 0.584 ' HB2' HG23 ' W' ' 29' ' ' THR . 34.9 m-85 -107.8 139.42 42.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.927 -177.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 21' ' ' TYR . . . . . 0.688 ' HB3' HG23 ' W' ' 9' ' ' THR . 58.6 t80 -116.98 99.12 6.86 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 -175.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 22' ' ' ASN . . . . . 0.647 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.9 t-20 -56.62 108.87 0.54 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.27 -177.28 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.97 4.44 50.08 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 24' ' ' ARG . . . . . 0.577 ' HB3' HD21 ' W' ' 22' ' ' ASN . 23.6 tpt180 -63.75 -63.67 1.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.697 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 16.6 p -130.44 20.84 5.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.267 177.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 67.1 85.36 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.279 -175.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 27' ' ' GLU . . . . . 0.51 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 7.0 tp10 -142.17 160.29 40.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.172 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 28' ' ' SER . . . . . 0.572 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 6.3 m -114.54 140.11 49.03 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.261 -0.274 . . . . 0.0 110.718 172.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 29' ' ' THR . . . . . 0.584 HG23 ' HB2' ' W' ' 20' ' ' TYR . 1.7 t -144.23 136.37 26.4 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.521 176.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 30' ' ' TRP . . . . . 0.746 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 89.9 m95 -69.88 -70.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.704 0.288 . . . . 0.0 110.822 -174.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mp0 -86.94 -177.15 5.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.27 0.557 . . . . 0.0 111.054 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 32' ' ' LYS . . . . . 0.498 ' HD2' ' HB2' ' W' ' 37' ' ' LYS . 25.3 pttm -69.62 147.39 96.55 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.678 -174.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 33' ' ' PRO . . . . . 0.652 ' HD2' HD23 ' W' ' 36' ' ' LEU . 53.4 Cg_exo -64.71 163.94 25.87 Favored 'Trans proline' 0 C--N 1.336 -0.113 0 C-N-CA 123.573 2.848 . . . . 0.0 113.003 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -71.31 -27.66 63.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.147 -175.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.09 -20.52 21.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.455 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 36' ' ' LEU . . . . . 0.652 HD23 ' HD2' ' W' ' 33' ' ' PRO . 9.7 tp -97.1 101.65 13.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.811 -173.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' W' W ' 37' ' ' LYS . . . . . 0.498 ' HB2' ' HD2' ' W' ' 32' ' ' LYS . 27.9 mtpp . . . . . 0 C--O 1.245 0.828 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.591 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 101' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 10.2 Cg_endo . . . . . 0 N--CA 1.478 0.604 0 N-CA-C 111.072 -0.396 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 102' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.3 Cg_exo -77.71 148.65 25.87 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.946 2.431 . . . . 0.0 111.06 176.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 103' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.63 148.56 26.04 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.377 2.052 . . . . 0.0 112.661 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.29 149.19 33.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.926 172.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' P' P ' 105' ' ' ILE . . . . . 0.667 HG21 ' CD1' ' W' ' 30' ' ' TRP . 1.8 mp -78.19 148.62 74.93 Favored Pre-proline 0 C--N 1.32 -0.684 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.298 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.634 ' O ' HG22 ' P' ' 105' ' ' ILE . 73.0 Cg_endo -78.15 148.68 24.59 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.678 2.252 . . . . 0.0 111.126 164.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 107' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' P' ' 106' ' ' PRO . 4.4 Cg_exo -78.28 148.9 24.4 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.118 1.879 . . . . 0.0 111.093 171.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 108' ' ' PRO . . . . . 0.461 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 2.8 Cg_exo -77.58 148.53 26.16 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 121.503 1.469 . . . . 0.0 111.383 176.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 109' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 5.7 Cg_exo . . . . . 0 C--O 1.249 1.053 0 C-N-CA 123.248 2.632 . . . . 0.0 112.491 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.728 0 CA-C-O 119.988 -0.34 . . . . 0.0 112.353 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . 73.97 3.38 4.42 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.536 0.735 . . . . 0.0 112.299 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 68.7 p 53.51 -173.87 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.868 0.867 . . . . 0.0 112.325 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . 68.17 81.42 0.19 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.03 0.532 . . . . 0.0 111.269 177.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 m -70.49 109.11 2.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.66 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 6' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' W' ' 7' ' ' GLU . 18.5 t -170.55 -153.57 0.1 Allowed 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.79 -177.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 7' ' ' GLU . . . . . 0.965 ' HB3' ' HB2' ' W' ' 23' ' ' ASN . 0.9 OUTLIER 74.51 79.04 0.11 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.381 1.051 . . . . 0.0 108.423 -171.64 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' W' W ' 8' ' ' TRP . . . . . 0.647 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 20.7 m95 -124.73 112.26 16.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 109.834 -172.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 9' ' ' THR . . . . . 0.934 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -100.01 167.41 10.51 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 122.331 1.062 . . . . 0.0 111.673 176.013 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' W' W ' 10' ' ' GLU . . . . . 0.412 ' H ' ' HG2' ' W' ' 10' ' ' GLU . 8.3 pt-20 -102.94 112.33 25.1 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 112.594 -2.094 . . . . 0.0 110.359 -176.058 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 11' ' ' TYR . . . . . 0.452 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 3.4 m-85 -124.01 110.15 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.009 -175.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -99.22 123.34 43.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.702 175.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 69.0 p -81.83 170.8 15.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.477 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -13.02 62.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -80.69 -16.7 53.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.654 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.8 13.72 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.06 -0.591 . . . . 0.0 111.744 -176.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -104.35 124.24 48.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.544 0.211 . . . . 0.0 110.805 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 87.7 m -87.04 103.57 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.72 175.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 19' ' ' TYR . . . . . 0.71 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 1.1 p90 -118.17 166.14 12.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.202 0.525 . . . . 0.0 110.653 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 20' ' ' TYR . . . . . 0.712 ' HB2' HG23 ' W' ' 29' ' ' THR . 35.8 m-85 -107.92 144.61 34.94 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.313 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 21' ' ' TYR . . . . . 0.934 ' HB3' HG23 ' W' ' 9' ' ' THR . 50.9 t80 -117.1 114.04 23.15 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 22' ' ' ASN . . . . . 0.956 HD22 ' HE ' ' W' ' 24' ' ' ARG . 17.6 t-20 -74.68 101.95 4.44 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.767 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 23' ' ' ASN . . . . . 0.965 ' HB2' ' HB3' ' W' ' 7' ' ' GLU . 79.1 m-20 -80.81 -10.03 59.76 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 24' ' ' ARG . . . . . 0.956 ' HE ' HD22 ' W' ' 22' ' ' ASN . 15.4 ttp180 -49.9 -59.51 3.79 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.125 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 25' ' ' THR . . . . . 0.445 HG23 ' HG2' ' W' ' 24' ' ' ARG . 8.8 p -132.12 17.66 4.55 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.2 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 62.79 81.86 0.19 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.005 -172.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 27' ' ' GLU . . . . . 0.619 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.4 tp10 -142.03 167.53 21.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.54 -178.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 28' ' ' SER . . . . . 0.606 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -114.58 143.48 44.93 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 172.186 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' W' W ' 29' ' ' THR . . . . . 0.712 HG23 ' HB2' ' W' ' 20' ' ' TYR . 1.5 t -144.05 137.08 27.37 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 173.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 30' ' ' TRP . . . . . 0.71 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 92.4 m95 -69.89 -82.14 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.661 0.267 . . . . 0.0 111.464 -174.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -105.24 -155.79 0.55 Allowed 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.897 -172.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -53.12 115.82 8.21 Favored Pre-proline 0 N--CA 1.464 0.243 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -168.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 33' ' ' PRO . . . . . 0.467 ' HB2' ' HB3' ' W' ' 36' ' ' LEU . 36.5 Cg_exo -65.09 148.31 89.2 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 123.203 2.602 . . . . 0.0 111.286 169.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.63 -37.93 68.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.452 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -94.84 24.82 4.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.001 0.429 . . . . 0.0 111.174 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' W' W ' 36' ' ' LEU . . . . . 0.586 HD22 ' CD1' ' W' ' 8' ' ' TRP . 34.8 tp -156.45 43.2 0.39 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.011 0.91 . . . . 0.0 108.811 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.597 -179.269 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' P' P ' 101' ' ' PRO . . . . . 0.497 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 1.7 Cg_endo . . . . . 0 N--CA 1.474 0.377 0 N-CA-C 110.187 -0.736 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 102' ' ' PRO . . . . . 0.497 ' HD3' ' HA ' ' P' ' 101' ' ' PRO . 4.9 Cg_exo -78.06 148.95 25.09 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.928 2.419 . . . . 0.0 111.99 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 103' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.94 148.68 25.23 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.545 2.163 . . . . 0.0 111.629 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 104' ' ' LEU . . . . . 0.444 ' O ' HD12 ' P' ' 104' ' ' LEU . 3.5 pp -78.05 148.91 34.08 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.367 173.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 105' ' ' ILE . . . . . 0.624 HG22 ' O ' ' P' ' 106' ' ' PRO . 1.7 mp -78.45 148.81 74.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.624 ' O ' HG22 ' P' ' 105' ' ' ILE . 60.2 Cg_endo -78.14 148.88 24.79 Favored 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.07 1.846 . . . . 0.0 110.682 162.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 107' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 72.6 Cg_endo -77.95 149.14 25.6 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.625 1.55 . . . . 0.0 112.111 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 108' ' ' PRO . . . . . 0.494 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 5.6 Cg_exo -78.0 148.74 25.11 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.298 1.998 . . . . 0.0 112.106 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 109' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 2.6 Cg_exo . . . . . 0 C--O 1.249 1.042 0 C-N-CA 123.372 2.715 . . . . 0.0 111.233 174.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.797 0 N-CA-C 112.164 -0.374 . . . . 0.0 112.164 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.21 151.98 50.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 13.2 t -167.71 178.93 5.05 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . 64.1 176.74 0.18 Allowed 'General case' 0 C--O 1.237 0.423 0 O-C-N 124.058 0.849 . . . . 0.0 112.1 177.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 5' ' ' VAL . . . . . 0.545 HG21 ' HB2' ' W' ' 34' ' ' GLN . 12.5 m -113.2 119.62 61.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.558 0.694 . . . . 0.0 110.841 174.088 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 6' ' ' SER . . . . . 0.767 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.1 t -169.83 -158.73 0.19 Allowed 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -176.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 7' ' ' GLU . . . . . 0.417 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 6.2 mm-40 61.77 77.73 0.32 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -168.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 8' ' ' TRP . . . . . 0.786 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 45.1 m95 -124.19 124.74 43.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.464 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 9' ' ' THR . . . . . 0.679 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -108.62 167.99 9.65 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-O 122.651 1.215 . . . . 0.0 111.89 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' W' W ' 10' ' ' GLU . . . . . 0.495 ' CD ' ' H ' ' W' ' 10' ' ' GLU . 0.7 OUTLIER -106.54 115.99 31.16 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 111.838 -2.437 . . . . 0.0 110.455 -177.825 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -124.08 116.03 22.12 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.537 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 12' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' W' ' 17' ' ' LYS . 48.5 mtmt -103.69 113.24 26.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 77.2 p -79.92 173.98 12.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.161 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.88 -6.0 38.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.543 . . . . 0.0 111.102 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -84.99 -3.66 58.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.766 178.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.8 28.24 55.09 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 17' ' ' LYS . . . . . 0.44 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.3 mmtm -105.94 126.44 52.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.761 -175.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 95.8 m -88.3 101.84 14.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.041 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 19' ' ' TYR . . . . . 0.652 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.5 OUTLIER -115.64 163.52 15.68 Favored 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.377 178.406 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' W' W ' 20' ' ' TYR . . . . . 0.633 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 26.9 m-85 -107.81 143.11 36.85 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 121.454 0.645 . . . . 0.0 109.763 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 21' ' ' TYR . . . . . 0.679 ' HB3' HG23 ' W' ' 9' ' ' THR . 58.1 t80 -117.24 100.94 8.04 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 22' ' ' ASN . . . . . 0.786 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 3.8 t-20 -55.28 111.92 0.98 Allowed 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.52 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 23' ' ' ASN . . . . . 0.417 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 54.2 t30 -98.52 5.02 48.27 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.054 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -61.33 -65.51 0.68 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.16 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 25' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' W' ' 26' ' ' LEU . 8.8 t -132.16 18.18 4.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.089 177.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 26' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' W' ' 25' ' ' THR . 4.3 mm? 71.06 85.04 0.13 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.221 -177.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 27' ' ' GLU . . . . . 0.518 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 1.6 tt0 -141.66 161.24 38.41 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.224 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 28' ' ' SER . . . . . 0.483 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 31.2 m -114.4 146.41 40.62 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 121.836 -0.54 . . . . 0.0 111.017 174.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 29' ' ' THR . . . . . 0.633 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 4.3 p -143.35 134.34 25.55 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 30' ' ' TRP . . . . . 0.652 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 80.6 m95 -69.76 -64.69 0.83 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.577 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -105.37 -164.4 1.03 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 32' ' ' LYS . . . . . 0.887 ' HD3' ' HA ' ' W' ' 37' ' ' LYS . 56.6 mttp -52.91 132.61 48.74 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 33' ' ' PRO . . . . . 0.507 ' HG2' HD23 ' W' ' 36' ' ' LEU . 35.8 Cg_exo -65.33 -159.78 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.497 3.464 . . . . 0.0 113.916 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 34' ' ' GLN . . . . . 0.545 ' HB2' HG21 ' W' ' 5' ' ' VAL . 49.9 mt-30 -78.69 -68.04 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.178 -173.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -85.0 -8.55 58.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.176 0.512 . . . . 0.0 110.865 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' W' W ' 36' ' ' LEU . . . . . 0.507 HD23 ' HG2' ' W' ' 33' ' ' PRO . 38.0 tp -98.79 98.71 9.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.871 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' W' W ' 37' ' ' LYS . . . . . 0.887 ' HA ' ' HD3' ' W' ' 32' ' ' LYS . 62.6 pttt . . . . . 0 C--O 1.246 0.88 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.202 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 101' ' ' PRO . . . . . 0.417 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 2.5 Cg_endo . . . . . 0 N--CA 1.476 0.485 0 N-CA-C 110.092 -0.772 . . . . 0.0 110.092 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 102' ' ' PRO . . . . . 0.459 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.27 149.14 24.61 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.63 2.22 . . . . 0.0 112.382 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 103' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.7 Cg_exo -78.0 148.87 25.21 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.244 2.629 . . . . 0.0 111.277 174.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 86.3 mt -78.09 149.09 33.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.016 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 105' ' ' ILE . . . . . 0.651 HG21 ' CD1' ' W' ' 30' ' ' TRP . 1.5 mp -78.52 148.55 73.68 Favored Pre-proline 0 C--N 1.326 -0.431 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.381 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.637 ' O ' HG22 ' P' ' 105' ' ' ILE . 72.0 Cg_endo -77.78 148.59 25.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.927 1.752 . . . . 0.0 110.078 164.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 107' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 72.7 Cg_endo -78.25 148.9 24.49 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.644 1.563 . . . . 0.0 112.468 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 108' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 5.2 Cg_exo -77.76 148.76 25.85 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.894 2.396 . . . . 0.0 111.342 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' P' P ' 109' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo . . . . . 0 C--O 1.251 1.139 0 C-N-CA 122.609 2.206 . . . . 0.0 111.753 -179.745 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.905 -0.478 . . . . 0.0 111.905 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.26 -39.39 15.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.085 0.469 . . . . 0.0 111.059 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 7.0 t -89.23 123.01 33.06 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.237 0.542 . . . . 0.0 109.736 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -141.23 100.14 3.73 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.505 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 5' ' ' VAL . . . . . 0.415 ' HB ' ' OE2' ' W' ' 35' ' ' GLU . 9.3 m -82.08 74.69 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.44 0.638 . . . . 0.0 109.912 176.377 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 6' ' ' SER . . . . . 0.461 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 9.3 t -171.93 -152.92 0.08 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.883 -177.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 68.6 83.91 0.16 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.422 1.106 . . . . 0.0 109.314 -169.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 8' ' ' TRP . . . . . 0.726 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 49.0 m95 -124.94 114.87 19.73 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.729 -1.578 . . . . 0.0 108.662 -175.334 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 9' ' ' THR . . . . . 0.625 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -99.93 173.58 6.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.94 0.876 . . . . 0.0 112.056 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' W' W ' 10' ' ' GLU . . . . . 0.454 ' N ' ' OG1' ' W' ' 9' ' ' THR . 37.9 mt-10 -106.84 117.04 33.0 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 113.786 -1.552 . . . . 0.0 110.111 -176.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -127.02 106.69 9.45 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.686 -179.14 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -90.15 113.4 25.16 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.921 175.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.9 p -75.37 161.47 29.23 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.29 -19.8 64.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -65.67 -37.99 88.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.003 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.17 36.68 1.45 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.806 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -119.48 135.31 54.82 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 37.4 m -86.9 101.67 13.62 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 19' ' ' TYR . . . . . 0.77 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.15 162.41 18.27 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.615 178.279 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' W' W ' 20' ' ' TYR . . . . . 0.801 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 54.1 m-85 -107.71 150.62 26.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.209 -175.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 21' ' ' TYR . . . . . 0.625 ' HB3' HG23 ' W' ' 9' ' ' THR . 48.3 t80 -117.31 96.38 5.39 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.074 0.94 . . . . 0.0 108.49 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 22' ' ' ASN . . . . . 1.022 HD22 ' HB2' ' W' ' 24' ' ' ARG . 8.8 t-20 -55.01 120.2 6.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.027 -1.897 . . . . 0.0 111.198 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -89.45 -12.79 39.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 24' ' ' ARG . . . . . 1.022 ' HB2' HD22 ' W' ' 22' ' ' ASN . 33.3 mtp180 -45.92 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 14.9 t -110.98 25.16 12.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.118 175.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 26' ' ' LEU . . . . . 0.406 ' HA ' HD22 ' W' ' 26' ' ' LEU . 0.6 OUTLIER 63.8 86.69 0.12 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.171 -173.881 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' W' W ' 27' ' ' GLU . . . . . 0.524 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 8.4 tp10 -142.26 165.1 28.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.46 -174.091 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 28' ' ' SER . . . . . 0.604 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 4.3 m -114.53 152.46 31.7 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.622 171.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 29' ' ' THR . . . . . 0.801 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 45.7 p -143.9 135.11 25.67 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 30' ' ' TRP . . . . . 0.812 ' CH2' HD13 ' P' ' 105' ' ' ILE . 77.7 m95 -69.81 -65.86 0.66 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 118.293 0.497 . . . . 0.0 110.821 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -105.33 -175.52 2.82 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.959 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 32' ' ' LYS . . . . . 0.419 ' HG3' ' HB3' ' W' ' 36' ' ' LEU . 38.5 ttmt -62.74 128.9 92.48 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.636 -174.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 33' ' ' PRO . . . . . 0.624 ' HD2' HD12 ' W' ' 36' ' ' LEU . 50.2 Cg_exo -64.82 153.85 75.83 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.706 2.937 . . . . 0.0 112.509 171.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -63.83 -30.94 71.98 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.264 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' W' W ' 35' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' W' ' 35' ' ' GLU . 5.6 pt-20 -85.8 6.95 25.75 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.425 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' W' W ' 36' ' ' LEU . . . . . 0.666 ' HG ' ' CD1' ' W' ' 8' ' ' TRP . 1.0 OUTLIER -103.68 110.96 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' W' W ' 37' ' ' LYS . . . . . 0.494 ' H ' ' HG3' ' W' ' 37' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.281 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.479 0.664 0 N-CA-C 110.535 -0.602 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' P' P ' 102' ' ' PRO . . . . . 0.463 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 6.0 Cg_exo -78.31 149.07 24.43 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.964 2.443 . . . . 0.0 111.249 173.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 103' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.0 Cg_exo -77.87 148.83 25.57 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.21 1.94 . . . . 0.0 111.57 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 56.1 tp -78.08 148.77 34.09 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 105' ' ' ILE . . . . . 0.826 HD12 ' H ' ' P' ' 105' ' ' ILE . 1.1 mp -78.31 148.95 75.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.515 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 106' ' ' PRO . . . . . 0.604 ' CD ' ' HB2' ' W' ' 28' ' ' SER . 73.0 Cg_endo -78.18 148.86 24.65 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.195 2.597 . . . . 0.0 109.663 160.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 107' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' P' ' 106' ' ' PRO . 3.2 Cg_exo -77.98 148.76 25.17 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.021 1.148 . . . . 0.0 111.535 177.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -78.02 148.97 25.25 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.461 2.107 . . . . 0.0 112.717 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' P' P ' 109' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 C--O 1.244 0.812 0 C-N-CA 122.438 2.092 . . . . 0.0 111.978 176.451 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' W' W ' 6' ' ' SER . . . . . 0.439 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.7 t . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' W' W ' 7' ' ' GLU . . . . . 0.729 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 35.8 mt-10 71.8 77.81 0.16 Allowed 'General case' 0 C--N 1.322 -0.622 0 O-C-N 124.472 1.108 . . . . 0.0 108.721 -178.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 8' ' ' TRP . . . . . 0.696 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 27.4 m95 -124.5 111.55 15.83 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.897 -173.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 9' ' ' THR . . . . . 0.521 HG23 ' HB3' ' W' ' 21' ' ' TYR . 2.2 t -99.69 -174.4 2.7 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 122.413 1.101 . . . . 0.0 110.468 177.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 10' ' ' GLU . . . . . 0.515 ' N ' ' OG1' ' W' ' 9' ' ' THR . 16.7 mt-10 -110.99 122.28 47.48 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.846 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 11' ' ' TYR . . . . . 0.543 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 1.9 m-85 -128.83 115.59 18.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.407 0.623 . . . . 0.0 110.046 175.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -96.9 120.63 37.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.067 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' W' W ' 13' ' ' THR . . . . . 0.412 ' OG1' ' HB3' ' W' ' 17' ' ' LYS . 16.4 p -90.71 165.66 13.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.334 175.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -18.4 61.38 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -171.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' W' W ' 15' ' ' ASP . . . . . 0.448 ' OD2' ' HB2' ' W' ' 17' ' ' LYS . 6.3 p-10 -84.73 -3.19 58.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 110.954 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.39 17.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.881 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' W' W ' 17' ' ' LYS . . . . . 0.448 ' HB2' ' OD2' ' W' ' 15' ' ' ASP . 14.7 tppt? -97.86 130.21 44.78 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -177.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.7 94.06 9.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' W' W ' 19' ' ' TYR . . . . . 0.625 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.0 OUTLIER -108.11 157.58 18.15 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.748 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' W' W ' 20' ' ' TYR . . . . . 0.699 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 85.5 m-85 -107.98 145.55 33.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.556 0.693 . . . . 0.0 110.232 -173.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 21' ' ' TYR . . . . . 0.521 ' HB3' HG23 ' W' ' 9' ' ' THR . 40.8 t80 -117.53 101.71 8.59 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 22' ' ' ASN . . . . . 0.696 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.3 t-20 -56.92 113.83 1.84 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 113.602 -1.636 . . . . 0.0 110.434 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 23' ' ' ASN . . . . . 0.729 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 5.9 t30 -92.28 -7.28 48.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 24' ' ' ARG . . . . . 0.45 ' HB3' HD21 ' W' ' 22' ' ' ASN . 0.5 OUTLIER -54.89 -60.63 3.1 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.226 -176.369 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' W' W ' 25' ' ' THR . . . . . 0.411 HG23 ' HD2' ' W' ' 24' ' ' ARG . 10.1 p -132.24 20.73 4.42 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.393 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 26' ' ' LEU . . . . . 0.412 ' HA ' HD22 ' W' ' 26' ' ' LEU . 0.5 OUTLIER 65.1 81.92 0.2 Allowed 'General case' 0 CA--C 1.531 0.233 0 O-C-N 123.79 0.681 . . . . 0.0 110.265 -174.919 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' W' W ' 27' ' ' GLU . . . . . 0.477 ' HB3' ' CB ' ' W' ' 22' ' ' ASN . 9.9 tp10 -141.96 166.37 24.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.047 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 28' ' ' SER . . . . . 0.477 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -114.35 149.83 35.49 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 122.077 -0.389 . . . . 0.0 111.008 174.648 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' W' W ' 29' ' ' THR . . . . . 0.699 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 15.0 p -143.43 138.53 29.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 172.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 30' ' ' TRP . . . . . 0.625 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 90.4 m95 -70.21 -70.78 0.27 Allowed 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.682 178.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.0 -160.65 0.77 Allowed 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.88 -179.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 32' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' W' ' 33' ' ' PRO . 97.3 mttt -57.39 128.68 79.26 Favored Pre-proline 0 C--O 1.231 0.117 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 33' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' W' ' 36' ' ' LEU . 74.3 Cg_exo -64.59 -178.82 0.76 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.51 3.474 . . . . 0.0 113.594 170.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -72.23 -52.29 17.11 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.426 -177.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -80.0 -23.48 41.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 111.372 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' W' W ' 36' ' ' LEU . . . . . 0.558 HD22 ' CD1' ' W' ' 8' ' ' TRP . 12.8 tp -84.87 101.45 12.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.564 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 46.9 mttp . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.692 -167.89 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo . . . . . 0 N--CA 1.481 0.783 0 N-CA-C 109.464 -1.014 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' P' P ' 102' ' ' PRO . . . . . 0.503 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 72.5 Cg_endo -77.99 148.66 25.05 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.51 1.473 . . . . 0.0 113.061 -177.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 103' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.6 Cg_exo -78.22 148.94 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.958 3.106 . . . . 0.0 111.543 171.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 104' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' P' ' 104' ' ' LEU . 4.3 mm? -78.12 148.63 34.09 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 167.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 105' ' ' ILE . . . . . 0.704 HG22 ' O ' ' P' ' 106' ' ' PRO . 2.0 mp -78.48 148.56 73.82 Favored Pre-proline 0 C--N 1.322 -0.592 0 C-N-CA 120.333 -0.547 . . . . 0.0 109.681 176.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 106' ' ' PRO . . . . . 0.704 ' O ' HG22 ' P' ' 105' ' ' ILE . 71.7 Cg_endo -78.16 148.69 24.57 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 121.825 1.683 . . . . 0.0 110.396 163.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 107' ' ' PRO . . . . . 0.489 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 5.7 Cg_exo -78.07 148.84 24.98 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.163 1.242 . . . . 0.0 111.878 177.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' P' P ' 108' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 2.8 Cg_exo . . . . . 0 N--CA 1.458 -0.587 0 C-N-CA 122.731 2.288 . . . . 0.0 111.083 171.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 6' ' ' SER . . . . . . . . . . . . . 21.3 t . . . . . 0 C--O 1.235 0.313 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' W' W ' 7' ' ' GLU . . . . . 0.406 ' HB3' ' HB2' ' W' ' 23' ' ' ASN . 46.2 mt-10 72.85 85.26 0.12 Allowed 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 124.637 1.21 . . . . 0.0 109.538 -176.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 8' ' ' TRP . . . . . 0.626 ' CZ3' ' ND2' ' W' ' 22' ' ' ASN . 47.3 m95 -124.29 134.89 53.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 113.745 -1.57 . . . . 0.0 110.041 -176.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 9' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 1.5 t -121.32 -179.19 3.99 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 122.414 1.102 . . . . 0.0 110.702 174.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 10' ' ' GLU . . . . . 0.497 ' N ' ' OG1' ' W' ' 9' ' ' THR . 38.4 mt-10 -112.05 119.46 38.54 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 112.515 -2.13 . . . . 0.0 109.492 -178.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -123.73 88.59 2.94 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.817 0.817 . . . . 0.0 109.554 175.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -80.24 107.3 12.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.887 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 70.8 p -74.86 173.61 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.054 0.454 . . . . 0.0 111.78 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.5 -18.08 64.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.996 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.4 -23.09 62.7 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.883 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.18 29.93 10.77 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.668 -175.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 37.1 tptt -107.19 131.98 53.56 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 -176.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.2 m -87.41 97.97 11.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.701 0.286 . . . . 0.0 110.37 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 19' ' ' TYR . . . . . 0.608 ' CD2' HD11 ' P' ' 105' ' ' ILE . 0.2 OUTLIER -118.31 161.87 19.21 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.102 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' W' W ' 20' ' ' TYR . . . . . 0.681 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 52.8 m-85 -107.66 144.5 34.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.99 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 21' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -117.16 126.17 52.38 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 22' ' ' ASN . . . . . 0.862 ' ND2' ' H ' ' W' ' 24' ' ' ARG . 3.9 t-20 -91.17 120.62 32.26 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.024 -1.444 . . . . 0.0 111.396 -170.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 23' ' ' ASN . . . . . 0.406 ' HB2' ' HB3' ' W' ' 7' ' ' GLU . 19.5 m120 -91.58 2.41 56.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.868 172.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 24' ' ' ARG . . . . . 0.862 ' H ' ' ND2' ' W' ' 22' ' ' ASN . 60.9 ttt180 -59.94 -68.3 0.3 Allowed 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.664 0.745 . . . . 0.0 110.573 -178.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 25' ' ' THR . . . . . 0.618 HG23 ' HG2' ' W' ' 24' ' ' ARG . 21.9 p -126.47 21.66 7.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.577 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 63.92 76.03 0.37 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.117 -173.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 27' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' W' ' 28' ' ' SER . 5.5 tp10 -127.76 159.0 36.13 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.457 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 28' ' ' SER . . . . . 0.646 ' HB3' HG23 ' P' ' 105' ' ' ILE . 0.1 OUTLIER -114.59 151.46 33.41 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 171.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' W' W ' 29' ' ' THR . . . . . 0.681 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 11.3 p -143.55 131.25 21.33 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 30' ' ' TRP . . . . . 0.568 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 94.7 m95 -69.92 -50.49 41.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 0.0 110.222 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -105.41 -167.97 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.001 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -77.81 140.38 62.95 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.448 -174.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 33' ' ' PRO . . . . . 0.953 ' HD2' HD23 ' W' ' 36' ' ' LEU . 54.0 Cg_exo -64.35 161.5 34.28 Favored 'Trans proline' 0 N--CA 1.474 0.364 0 C-N-CA 123.383 2.722 . . . . 0.0 112.231 170.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -95.82 -17.82 20.86 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.028 0.442 . . . . 0.0 110.568 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' W' W ' 35' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' W' ' 35' ' ' GLU . 4.3 pt-20 -80.93 -9.71 59.8 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.714 0.768 . . . . 0.0 109.038 170.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 36' ' ' LEU . . . . . 0.953 HD23 ' HD2' ' W' ' 33' ' ' PRO . 24.2 tp -101.88 113.25 26.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.978 174.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.436 -0.792 . . . . 0.0 110.42 -173.667 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo . . . . . 0 N--CA 1.477 0.512 0 N-CA-C 109.602 -0.961 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' P' P ' 102' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.3 Cg_endo -78.02 148.94 25.21 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.393 2.062 . . . . 0.0 111.987 177.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 103' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.4 Cg_exo -78.12 148.57 24.58 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.01 177.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 104' ' ' LEU . . . . . 0.687 ' H ' HD23 ' P' ' 104' ' ' LEU . 2.4 pt? -77.91 148.79 34.39 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 173.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 105' ' ' ILE . . . . . 0.646 HG23 ' HB3' ' W' ' 28' ' ' SER . 2.0 mp -78.34 148.78 74.7 Favored Pre-proline 0 C--N 1.319 -0.738 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 170.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 106' ' ' PRO . . . . . 0.623 ' O ' HG22 ' P' ' 105' ' ' ILE . 72.4 Cg_endo -78.19 148.92 24.68 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 121.176 1.25 . . . . 0.0 110.477 163.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.38 149.15 24.29 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.334 2.023 . . . . 0.0 111.544 172.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo . . . . . 0 N--CA 1.46 -0.482 0 C-N-CA 121.877 1.718 . . . . 0.0 111.167 177.427 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' W' W ' 6' ' ' SER . . . . . 0.535 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 96.9 p . . . . . 0 N--CA 1.435 -1.2 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 73.68 77.79 0.13 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -172.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 8' ' ' TRP . . . . . 0.623 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 43.5 m95 -124.03 125.94 45.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.282 -174.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 9' ' ' THR . . . . . 0.478 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 9.9 t -115.98 -171.63 2.02 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.617 1.199 . . . . 0.0 110.513 173.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 10' ' ' GLU . . . . . 0.606 ' HB3' ' HE3' ' W' ' 12' ' ' LYS . 40.4 mt-10 -112.33 122.13 46.84 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.372 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -127.37 107.22 9.78 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.417 0.627 . . . . 0.0 110.396 176.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 12' ' ' LYS . . . . . 0.606 ' HE3' ' HB3' ' W' ' 10' ' ' GLU . 0.0 OUTLIER -100.61 118.39 36.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.327 -178.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.6 p -75.0 168.24 20.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.673 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.42 -23.76 66.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.307 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -85.14 -10.63 56.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.441 178.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.86 58.81 1.15 Allowed Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.007 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 17' ' ' LYS . . . . . 0.58 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.7 mmtm -119.14 144.0 46.89 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.9 m -99.34 95.71 7.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.275 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 19' ' ' TYR . . . . . 0.742 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.35 165.69 13.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.915 175.768 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' W' W ' 20' ' ' TYR . . . . . 0.623 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 42.2 m-85 -107.67 144.69 34.39 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.261 0.553 . . . . 0.0 109.822 -175.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 21' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -117.3 99.34 6.95 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.337 1.065 . . . . 0.0 108.44 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 22' ' ' ASN . . . . . 0.757 HD21 ' H ' ' W' ' 25' ' ' THR . 4.3 t30 -57.17 101.65 0.07 Allowed 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 112.737 -2.029 . . . . 0.0 110.944 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -84.31 -1.52 55.5 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 24' ' ' ARG . . . . . 0.723 ' HB3' ' OD1' ' W' ' 22' ' ' ASN . 19.7 ttp180 -56.36 -61.41 2.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.893 177.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 25' ' ' THR . . . . . 0.757 ' H ' HD21 ' W' ' 22' ' ' ASN . 5.2 p -132.4 19.35 4.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.612 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 26' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' W' ' 26' ' ' LEU . 0.5 OUTLIER 63.96 81.82 0.2 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.527 0.68 . . . . 0.0 109.8 -173.268 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' W' W ' 27' ' ' GLU . . . . . 0.587 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.2 tp10 -142.3 165.64 26.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.215 -178.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 28' ' ' SER . . . . . 0.552 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 14.8 m -114.75 151.92 32.93 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.523 0.201 . . . . 0.0 111.535 173.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 29' ' ' THR . . . . . 0.623 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 10.5 p -143.84 137.02 27.65 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 172.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 30' ' ' TRP . . . . . 0.795 ' CH2' HD13 ' P' ' 105' ' ' ILE . 80.1 m95 -69.84 -57.99 4.41 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 121.774 -0.579 . . . . 0.0 110.459 176.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -105.17 -174.06 2.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.994 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 32' ' ' LYS . . . . . 0.476 ' HD3' ' OXT' ' W' ' 37' ' ' LYS . 60.3 mttp -52.74 142.46 33.06 Favored Pre-proline 0 C--O 1.238 0.493 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.751 -178.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 33' ' ' PRO . . . . . 0.509 ' HG2' HD23 ' W' ' 36' ' ' LEU . 46.1 Cg_exo -64.84 -165.79 0.08 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.013 3.142 . . . . 0.0 113.256 171.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -92.61 -40.76 10.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.569 -172.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' W' W ' 35' ' ' GLU . . . . . 0.415 ' H ' ' CD ' ' W' ' 35' ' ' GLU . 0.0 OUTLIER -97.22 -28.3 14.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.025 178.663 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' W' W ' 36' ' ' LEU . . . . . 0.509 HD23 ' HG2' ' W' ' 33' ' ' PRO . 24.7 tp -77.25 84.91 3.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.405 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' W' W ' 37' ' ' LYS . . . . . 0.476 ' OXT' ' HD3' ' W' ' 32' ' ' LYS . 56.1 mttp . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.101 174.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo . . . . . 0 N--CA 1.479 0.653 0 N-CA-C 110.205 -0.729 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' P' P ' 102' ' ' PRO . . . . . 0.514 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.9 Cg_endo -77.82 148.74 25.62 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.44 2.093 . . . . 0.0 112.239 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 103' ' ' PRO . . . . . 0.514 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 9.9 Cg_exo -77.69 148.87 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 123.422 2.748 . . . . 0.0 111.637 174.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 82.1 mt -78.28 148.98 33.64 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' P' P ' 105' ' ' ILE . . . . . 0.795 HD13 ' CH2' ' W' ' 30' ' ' TRP . 2.1 mp -77.87 148.97 76.6 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 120.251 -0.579 . . . . 0.0 109.513 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 106' ' ' PRO . . . . . 0.552 ' CD ' ' HB2' ' W' ' 28' ' ' SER . 72.1 Cg_endo -78.13 148.6 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.698 1.599 . . . . 0.0 109.944 165.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.32 148.94 24.32 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.609 2.206 . . . . 0.0 112.872 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo . . . . . 0 N--CA 1.457 -0.618 0 C-N-CA 122.025 1.817 . . . . 0.0 109.617 166.016 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' W' W ' 6' ' ' SER . . . . . 0.544 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 52.8 m . . . . . 0 N--CA 1.442 -0.841 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 7' ' ' GLU . . . . . 0.666 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 39.6 mm-40 67.77 80.45 0.21 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -170.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 8' ' ' TRP . . . . . 0.804 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 25.2 m95 -124.61 111.24 15.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.716 -170.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 9' ' ' THR . . . . . 0.476 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.6 OUTLIER -99.91 172.39 7.26 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.812 1.291 . . . . 0.0 111.5 175.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' W' W ' 10' ' ' GLU . . . . . 0.476 ' N ' ' OG1' ' W' ' 9' ' ' THR . 8.4 pt-20 -108.57 119.89 40.83 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 112.012 -2.358 . . . . 0.0 110.225 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -124.48 105.34 9.32 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.527 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.13 115.15 25.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.575 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -79.83 170.24 16.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.736 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.78 -16.84 62.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.779 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -84.94 0.18 52.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.259 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.86 26.35 60.65 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.001 -0.619 . . . . 0.0 111.71 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -105.47 124.95 50.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 91.9 m -86.91 106.34 17.71 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 19' ' ' TYR . . . . . 0.649 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.7 OUTLIER -109.59 163.91 13.02 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.588 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' W' W ' 20' ' ' TYR . . . . . 0.629 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 32.8 m-85 -107.67 141.55 39.0 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.366 0.603 . . . . 0.0 109.868 -176.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 21' ' ' TYR . . . . . 0.476 ' HB3' HG23 ' W' ' 9' ' ' THR . 51.7 t80 -117.39 94.72 4.66 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -177.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 22' ' ' ASN . . . . . 0.804 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 2.4 t-20 -51.19 109.04 0.29 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.056 -1.883 . . . . 0.0 110.461 -178.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 23' ' ' ASN . . . . . 0.666 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 65.0 t30 -91.7 5.8 48.34 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 174.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -64.61 0.86 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.269 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -131.93 17.3 4.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 -178.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 26' ' ' LEU . . . . . 0.437 HD13 ' HA ' ' W' ' 26' ' ' LEU . 4.1 mm? 67.24 61.35 0.48 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 122.363 1.078 . . . . 0.0 110.919 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 27' ' ' GLU . . . . . 0.587 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 2.4 tt0 -112.99 160.79 17.75 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.622 -1.626 . . . . 0.0 109.465 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 28' ' ' SER . . . . . 0.556 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 34.4 m -114.45 147.4 39.34 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 122.05 -0.406 . . . . 0.0 111.404 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 29' ' ' THR . . . . . 0.629 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 3.2 p -143.45 137.21 28.43 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 30' ' ' TRP . . . . . 0.666 ' CD1' HG21 ' P' ' 105' ' ' ILE . 72.3 m95 -72.15 -61.88 1.63 Allowed 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.729 -0.607 . . . . 0.0 110.652 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 31' ' ' GLU . . . . . 0.525 ' OE1' ' HG2' ' W' ' 32' ' ' LYS . 3.0 pt-20 -105.63 -161.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 119.347 -0.941 . . . . 0.0 111.138 172.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 32' ' ' LYS . . . . . 0.525 ' HG2' ' OE1' ' W' ' 31' ' ' GLU . 9.8 ptpp? -61.42 139.54 94.86 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-O 121.983 0.897 . . . . 0.0 113.055 -167.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 33' ' ' PRO . . . . . 0.65 ' HD2' HD23 ' W' ' 36' ' ' LEU . 71.5 Cg_exo -64.53 -178.62 0.71 Allowed 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 124.41 3.407 . . . . 0.0 114.116 172.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -51.36 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.57 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -94.5 3.46 55.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.452 -172.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' W' W ' 36' ' ' LEU . . . . . 0.65 HD23 ' HD2' ' W' ' 33' ' ' PRO . 6.5 tp -87.63 95.19 9.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.68 0.753 . . . . 0.0 109.775 177.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 pttm . . . . . 0 C--O 1.244 0.783 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.726 179.962 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' P' P ' 101' ' ' PRO . . . . . 0.43 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 7.2 Cg_exo . . . . . 0 N--CA 1.481 0.737 0 N-CA-C 109.992 -0.811 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' P' P ' 102' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.51 148.99 23.79 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.38 2.053 . . . . 0.0 111.98 -177.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 103' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.1 Cg_exo -78.12 148.51 24.54 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.852 2.368 . . . . 0.0 112.379 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.7 148.76 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 169.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' P' P ' 105' ' ' ILE . . . . . 0.666 HG21 ' CD1' ' W' ' 30' ' ' TRP . 2.0 mp -77.88 148.97 76.53 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 106' ' ' PRO . . . . . 0.66 ' O ' HG22 ' P' ' 105' ' ' ILE . 73.2 Cg_endo -78.34 148.81 24.13 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 121.614 1.542 . . . . 0.0 109.614 166.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 107' ' ' PRO . . . . . 0.523 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 73.7 Cg_endo -78.39 149.12 24.25 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.332 1.355 . . . . 0.0 113.14 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' P' P ' 108' ' ' PRO . . . . . 0.523 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 3.8 Cg_exo . . . . . 0 N--CA 1.463 -0.281 0 C-N-CA 123.055 2.503 . . . . 0.0 111.601 172.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 6' ' ' SER . . . . . 0.533 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 33.1 t . . . . . 0 CA--C 1.51 -0.561 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 7' ' ' GLU . . . . . 0.545 ' OE1' ' HD2' ' W' ' 24' ' ' ARG . 27.7 mt-10 63.0 79.89 0.25 Allowed 'General case' 0 N--CA 1.444 -0.725 0 CA-C-O 122.173 0.987 . . . . 0.0 108.808 -176.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 8' ' ' TRP . . . . . 0.647 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 36.0 m95 -124.08 124.73 43.17 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.833 -172.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 9' ' ' THR . . . . . 0.688 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.2 OUTLIER -112.43 176.84 4.85 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-O 122.117 0.961 . . . . 0.0 111.13 174.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' W' W ' 10' ' ' GLU . . . . . 0.487 ' N ' ' OG1' ' W' ' 9' ' ' THR . 43.3 mt-10 -111.95 118.9 36.76 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.822 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -123.96 119.12 28.66 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.837 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 12' ' ' LYS . . . . . 0.585 ' H ' ' HD2' ' W' ' 12' ' ' LYS . 0.0 OUTLIER -104.18 123.68 47.74 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.766 176.86 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 10.8 p -82.21 177.0 9.03 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.0 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.87 -26.86 62.67 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -175.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 15' ' ' ASP . . . . . 0.409 ' OD2' ' HG2' ' W' ' 17' ' ' LYS . 19.1 t70 -76.83 -28.16 55.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.499 -178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.78 29.27 5.34 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.299 -0.721 . . . . 0.0 111.299 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 17' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 40.9 mmtm -96.74 123.34 40.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.468 -0.366 . . . . 0.0 110.402 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 51.9 m -86.53 106.37 17.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.357 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 19' ' ' TYR . . . . . 0.746 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 2.5 p90 -117.98 169.62 9.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.037 0.446 . . . . 0.0 110.306 175.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 20' ' ' TYR . . . . . 0.584 ' HB2' HG23 ' W' ' 29' ' ' THR . 34.9 m-85 -107.8 139.42 42.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.927 -177.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 21' ' ' TYR . . . . . 0.688 ' HB3' HG23 ' W' ' 9' ' ' THR . 58.6 t80 -116.98 99.12 6.86 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 -175.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 22' ' ' ASN . . . . . 0.647 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.9 t-20 -56.62 108.87 0.54 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.27 -177.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.97 4.44 50.08 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 24' ' ' ARG . . . . . 0.577 ' HB3' HD21 ' W' ' 22' ' ' ASN . 23.6 tpt180 -63.75 -63.67 1.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.697 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 16.6 p -130.44 20.84 5.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.267 177.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 67.1 85.36 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.279 -175.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 27' ' ' GLU . . . . . 0.51 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 7.0 tp10 -142.17 160.29 40.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.172 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 28' ' ' SER . . . . . 0.572 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 6.3 m -114.54 140.11 49.03 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.261 -0.274 . . . . 0.0 110.718 172.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 29' ' ' THR . . . . . 0.584 HG23 ' HB2' ' W' ' 20' ' ' TYR . 1.7 t -144.23 136.37 26.4 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.521 176.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 30' ' ' TRP . . . . . 0.746 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 89.9 m95 -69.88 -70.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.704 0.288 . . . . 0.0 110.822 -174.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mp0 -86.94 -177.15 5.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.27 0.557 . . . . 0.0 111.054 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 32' ' ' LYS . . . . . 0.498 ' HD2' ' HB2' ' W' ' 37' ' ' LYS . 25.3 pttm -69.62 147.39 96.55 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.678 -174.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 33' ' ' PRO . . . . . 0.652 ' HD2' HD23 ' W' ' 36' ' ' LEU . 53.4 Cg_exo -64.71 163.94 25.87 Favored 'Trans proline' 0 C--N 1.336 -0.113 0 C-N-CA 123.573 2.848 . . . . 0.0 113.003 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -71.31 -27.66 63.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.147 -175.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.09 -20.52 21.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.455 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 36' ' ' LEU . . . . . 0.652 HD23 ' HD2' ' W' ' 33' ' ' PRO . 9.7 tp -97.1 101.65 13.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.811 -173.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' W' W ' 37' ' ' LYS . . . . . 0.498 ' HB2' ' HD2' ' W' ' 32' ' ' LYS . 27.9 mtpp . . . . . 0 C--O 1.245 0.828 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.591 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' P' P ' 101' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 10.2 Cg_endo . . . . . 0 N--CA 1.478 0.604 0 N-CA-C 111.072 -0.396 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' P' P ' 102' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.3 Cg_exo -77.71 148.65 25.87 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.946 2.431 . . . . 0.0 111.06 176.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 103' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.63 148.56 26.04 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.377 2.052 . . . . 0.0 112.661 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.29 149.19 33.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.926 172.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' P' P ' 105' ' ' ILE . . . . . 0.667 HG21 ' CD1' ' W' ' 30' ' ' TRP . 1.8 mp -78.19 148.62 74.93 Favored Pre-proline 0 C--N 1.32 -0.684 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.298 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 106' ' ' PRO . . . . . 0.634 ' O ' HG22 ' P' ' 105' ' ' ILE . 73.0 Cg_endo -78.15 148.68 24.59 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.678 2.252 . . . . 0.0 111.126 164.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 107' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' P' ' 106' ' ' PRO . 4.4 Cg_exo -78.28 148.9 24.4 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.118 1.879 . . . . 0.0 111.093 171.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' P' P ' 108' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 2.8 Cg_exo . . . . . 0 N--CA 1.458 -0.614 0 C-N-CA 121.503 1.469 . . . . 0.0 111.383 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 6' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' W' ' 7' ' ' GLU . 18.5 t . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 7' ' ' GLU . . . . . 0.965 ' HB3' ' HB2' ' W' ' 23' ' ' ASN . 0.9 OUTLIER 74.51 79.04 0.11 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.381 1.051 . . . . 0.0 108.423 -171.64 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' W' W ' 8' ' ' TRP . . . . . 0.647 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 20.7 m95 -124.73 112.26 16.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 109.834 -172.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 9' ' ' THR . . . . . 0.934 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -100.01 167.41 10.51 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 122.331 1.062 . . . . 0.0 111.673 176.013 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' W' W ' 10' ' ' GLU . . . . . 0.412 ' H ' ' HG2' ' W' ' 10' ' ' GLU . 8.3 pt-20 -102.94 112.33 25.1 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 112.594 -2.094 . . . . 0.0 110.359 -176.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 11' ' ' TYR . . . . . 0.452 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 3.4 m-85 -124.01 110.15 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.009 -175.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -99.22 123.34 43.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.702 175.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 69.0 p -81.83 170.8 15.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.477 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -13.02 62.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -80.69 -16.7 53.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.654 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.8 13.72 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.06 -0.591 . . . . 0.0 111.744 -176.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -104.35 124.24 48.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.544 0.211 . . . . 0.0 110.805 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 87.7 m -87.04 103.57 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.72 175.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 19' ' ' TYR . . . . . 0.71 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 1.1 p90 -118.17 166.14 12.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.202 0.525 . . . . 0.0 110.653 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 20' ' ' TYR . . . . . 0.712 ' HB2' HG23 ' W' ' 29' ' ' THR . 35.8 m-85 -107.92 144.61 34.94 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.313 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 21' ' ' TYR . . . . . 0.934 ' HB3' HG23 ' W' ' 9' ' ' THR . 50.9 t80 -117.1 114.04 23.15 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 22' ' ' ASN . . . . . 0.758 ' OD1' ' HB3' ' W' ' 24' ' ' ARG . 4.8 t30 -74.68 101.95 4.44 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.767 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 23' ' ' ASN . . . . . 0.965 ' HB2' ' HB3' ' W' ' 7' ' ' GLU . 79.1 m-20 -80.81 -10.03 59.76 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 24' ' ' ARG . . . . . 0.758 ' HB3' ' OD1' ' W' ' 22' ' ' ASN . 15.4 ttp180 -49.9 -59.51 3.79 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.125 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 25' ' ' THR . . . . . 0.73 ' H ' ' ND2' ' W' ' 22' ' ' ASN . 8.8 p -132.12 17.66 4.55 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.2 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 62.79 81.86 0.19 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.005 -172.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 27' ' ' GLU . . . . . 0.619 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.4 tp10 -142.03 167.53 21.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.54 -178.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 28' ' ' SER . . . . . 0.606 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -114.58 143.48 44.93 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 172.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' W' W ' 29' ' ' THR . . . . . 0.712 HG23 ' HB2' ' W' ' 20' ' ' TYR . 1.5 t -144.05 137.08 27.37 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 173.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 30' ' ' TRP . . . . . 0.71 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 92.4 m95 -69.89 -82.14 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.661 0.267 . . . . 0.0 111.464 -174.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -105.24 -155.79 0.55 Allowed 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.897 -172.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -53.12 115.82 8.21 Favored Pre-proline 0 N--CA 1.464 0.243 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -168.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 33' ' ' PRO . . . . . 0.467 ' HB2' ' HB3' ' W' ' 36' ' ' LEU . 36.5 Cg_exo -65.09 148.31 89.2 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 123.203 2.602 . . . . 0.0 111.286 169.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.63 -37.93 68.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.452 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -94.84 24.82 4.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.001 0.429 . . . . 0.0 111.174 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' W' W ' 36' ' ' LEU . . . . . 0.586 HD22 ' CD1' ' W' ' 8' ' ' TRP . 34.8 tp -156.45 43.2 0.39 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.011 0.91 . . . . 0.0 108.811 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.597 -179.269 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' P' P ' 101' ' ' PRO . . . . . 0.497 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 1.7 Cg_endo . . . . . 0 N--CA 1.474 0.377 0 N-CA-C 110.187 -0.736 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' P' P ' 102' ' ' PRO . . . . . 0.497 ' HD3' ' HA ' ' P' ' 101' ' ' PRO . 4.9 Cg_exo -78.06 148.95 25.09 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.928 2.419 . . . . 0.0 111.99 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 103' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.94 148.68 25.23 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.545 2.163 . . . . 0.0 111.629 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 104' ' ' LEU . . . . . 0.444 ' O ' HD12 ' P' ' 104' ' ' LEU . 3.5 pp -78.05 148.91 34.08 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.367 173.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 105' ' ' ILE . . . . . 0.624 HG22 ' O ' ' P' ' 106' ' ' PRO . 1.7 mp -78.45 148.81 74.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 106' ' ' PRO . . . . . 0.624 ' O ' HG22 ' P' ' 105' ' ' ILE . 60.2 Cg_endo -78.14 148.88 24.79 Favored 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.07 1.846 . . . . 0.0 110.682 162.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 107' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 72.6 Cg_endo -77.95 149.14 25.6 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.625 1.55 . . . . 0.0 112.111 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' P' P ' 108' ' ' PRO . . . . . 0.457 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 5.6 Cg_exo . . . . . 0 N--CA 1.458 -0.597 0 C-N-CA 122.298 1.998 . . . . 0.0 112.106 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 6' ' ' SER . . . . . 0.767 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.1 t . . . . . 0 N--CA 1.446 -0.658 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 7' ' ' GLU . . . . . 0.417 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 6.2 mm-40 61.77 77.73 0.32 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -168.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 8' ' ' TRP . . . . . 0.786 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 45.1 m95 -124.19 124.74 43.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.464 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 9' ' ' THR . . . . . 0.679 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -108.62 167.99 9.65 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-O 122.651 1.215 . . . . 0.0 111.89 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' W' W ' 10' ' ' GLU . . . . . 0.495 ' H ' ' CD ' ' W' ' 10' ' ' GLU . 0.7 OUTLIER -106.54 115.99 31.16 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 111.838 -2.437 . . . . 0.0 110.455 -177.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -124.08 116.03 22.12 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.537 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 12' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' W' ' 17' ' ' LYS . 48.5 mtmt -103.69 113.24 26.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 77.2 p -79.92 173.98 12.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.161 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.88 -6.0 38.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.543 . . . . 0.0 111.102 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -84.99 -3.66 58.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.766 178.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.8 28.24 55.09 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 17' ' ' LYS . . . . . 0.44 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.3 mmtm -105.94 126.44 52.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.761 -175.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 95.8 m -88.3 101.84 14.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.041 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 19' ' ' TYR . . . . . 0.652 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.5 OUTLIER -115.64 163.52 15.68 Favored 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.377 178.406 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' W' W ' 20' ' ' TYR . . . . . 0.633 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 26.9 m-85 -107.81 143.11 36.85 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 121.454 0.645 . . . . 0.0 109.763 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 21' ' ' TYR . . . . . 0.679 ' HB3' HG23 ' W' ' 9' ' ' THR . 58.1 t80 -117.24 100.94 8.04 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 22' ' ' ASN . . . . . 0.786 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 3.8 t-20 -55.28 111.92 0.98 Allowed 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.52 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 23' ' ' ASN . . . . . 0.417 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 5.3 t-20 -98.52 5.02 48.27 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -61.33 -65.51 0.68 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.16 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 25' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' W' ' 26' ' ' LEU . 8.8 t -132.16 18.18 4.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.089 177.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 26' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' W' ' 25' ' ' THR . 4.3 mm? 71.06 85.04 0.13 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.221 -177.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 27' ' ' GLU . . . . . 0.518 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 1.6 tt0 -141.66 161.24 38.41 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.224 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 28' ' ' SER . . . . . 0.483 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 31.2 m -114.4 146.41 40.62 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 121.836 -0.54 . . . . 0.0 111.017 174.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 29' ' ' THR . . . . . 0.633 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 4.3 p -143.35 134.34 25.55 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 30' ' ' TRP . . . . . 0.652 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 80.6 m95 -69.76 -64.69 0.83 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.577 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -105.37 -164.4 1.03 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 32' ' ' LYS . . . . . 0.887 ' HD3' ' HA ' ' W' ' 37' ' ' LYS . 56.6 mttp -52.91 132.61 48.74 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 33' ' ' PRO . . . . . 0.507 ' HG2' HD23 ' W' ' 36' ' ' LEU . 35.8 Cg_exo -65.33 -159.78 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.497 3.464 . . . . 0.0 113.916 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 49.9 mt-30 -78.69 -68.04 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.178 -173.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -85.0 -8.55 58.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.176 0.512 . . . . 0.0 110.865 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' W' W ' 36' ' ' LEU . . . . . 0.507 HD23 ' HG2' ' W' ' 33' ' ' PRO . 38.0 tp -98.79 98.71 9.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.871 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' W' W ' 37' ' ' LYS . . . . . 0.887 ' HA ' ' HD3' ' W' ' 32' ' ' LYS . 62.6 pttt . . . . . 0 C--O 1.246 0.88 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.202 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 101' ' ' PRO . . . . . 0.417 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 2.5 Cg_endo . . . . . 0 N--CA 1.476 0.485 0 N-CA-C 110.092 -0.772 . . . . 0.0 110.092 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 102' ' ' PRO . . . . . 0.459 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.27 149.14 24.61 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.63 2.22 . . . . 0.0 112.382 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 103' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.7 Cg_exo -78.0 148.87 25.21 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.244 2.629 . . . . 0.0 111.277 174.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 86.3 mt -78.09 149.09 33.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.016 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' P' P ' 105' ' ' ILE . . . . . 0.651 HG21 ' CD1' ' W' ' 30' ' ' TRP . 1.5 mp -78.52 148.55 73.68 Favored Pre-proline 0 C--N 1.326 -0.431 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 106' ' ' PRO . . . . . 0.637 ' O ' HG22 ' P' ' 105' ' ' ILE . 72.0 Cg_endo -77.78 148.59 25.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.927 1.752 . . . . 0.0 110.078 164.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 107' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 72.7 Cg_endo -78.25 148.9 24.49 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.644 1.563 . . . . 0.0 112.468 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' P' P ' 108' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 5.2 Cg_exo . . . . . 0 N--CA 1.459 -0.519 0 C-N-CA 122.894 2.396 . . . . 0.0 111.342 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 6' ' ' SER . . . . . 0.461 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 9.3 t . . . . . 0 N--CA 1.45 -0.447 0 CA-C-O 121.042 0.449 . . . . 0.0 110.883 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 68.6 83.91 0.16 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.422 1.106 . . . . 0.0 109.314 -169.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 8' ' ' TRP . . . . . 0.726 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 49.0 m95 -124.94 114.87 19.73 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.729 -1.578 . . . . 0.0 108.662 -175.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 9' ' ' THR . . . . . 0.625 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -99.93 173.58 6.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.94 0.876 . . . . 0.0 112.056 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' W' W ' 10' ' ' GLU . . . . . 0.454 ' N ' ' OG1' ' W' ' 9' ' ' THR . 37.9 mt-10 -106.84 117.04 33.0 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 113.786 -1.552 . . . . 0.0 110.111 -176.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -127.02 106.69 9.45 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.686 -179.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -90.15 113.4 25.16 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.921 175.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.9 p -75.37 161.47 29.23 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.29 -19.8 64.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -65.67 -37.99 88.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.003 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.17 36.68 1.45 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.806 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -119.48 135.31 54.82 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 37.4 m -86.9 101.67 13.62 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 19' ' ' TYR . . . . . 0.77 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.15 162.41 18.27 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.615 178.279 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' W' W ' 20' ' ' TYR . . . . . 0.801 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 54.1 m-85 -107.71 150.62 26.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.209 -175.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 21' ' ' TYR . . . . . 0.625 ' HB3' HG23 ' W' ' 9' ' ' THR . 48.3 t80 -117.31 96.38 5.39 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.074 0.94 . . . . 0.0 108.49 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 22' ' ' ASN . . . . . 0.756 ' OD1' ' HB2' ' W' ' 24' ' ' ARG . 2.0 t30 -55.01 120.2 6.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.027 -1.897 . . . . 0.0 111.198 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -89.45 -12.79 39.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 24' ' ' ARG . . . . . 0.756 ' HB2' ' OD1' ' W' ' 22' ' ' ASN . 33.3 mtp180 -45.92 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 25' ' ' THR . . . . . 0.67 ' H ' HD21 ' W' ' 22' ' ' ASN . 14.9 t -110.98 25.16 12.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.118 175.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 26' ' ' LEU . . . . . 0.406 ' HA ' HD22 ' W' ' 26' ' ' LEU . 0.6 OUTLIER 63.8 86.69 0.12 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.171 -173.881 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' W' W ' 27' ' ' GLU . . . . . 0.617 ' N ' HD22 ' W' ' 22' ' ' ASN . 8.4 tp10 -142.26 165.1 28.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.46 -174.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 28' ' ' SER . . . . . 0.604 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 4.3 m -114.53 152.46 31.7 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.622 171.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 29' ' ' THR . . . . . 0.801 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 45.7 p -143.9 135.11 25.67 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 30' ' ' TRP . . . . . 0.812 ' CH2' HD13 ' P' ' 105' ' ' ILE . 77.7 m95 -69.81 -65.86 0.66 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 118.293 0.497 . . . . 0.0 110.821 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -105.33 -175.52 2.82 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.959 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 32' ' ' LYS . . . . . 0.419 ' HG3' ' HB3' ' W' ' 36' ' ' LEU . 38.5 ttmt -62.74 128.9 92.48 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.636 -174.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 33' ' ' PRO . . . . . 0.624 ' HD2' HD12 ' W' ' 36' ' ' LEU . 50.2 Cg_exo -64.82 153.85 75.83 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.706 2.937 . . . . 0.0 112.509 171.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -63.83 -30.94 71.98 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.264 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' W' W ' 35' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' W' ' 35' ' ' GLU . 5.6 pt-20 -85.8 6.95 25.75 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.425 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' W' W ' 36' ' ' LEU . . . . . 0.666 ' HG ' ' CD1' ' W' ' 8' ' ' TRP . 1.0 OUTLIER -103.68 110.96 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' W' W ' 37' ' ' LYS . . . . . 0.494 ' H ' ' HG3' ' W' ' 37' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.281 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.479 0.664 0 N-CA-C 110.535 -0.602 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' P' P ' 102' ' ' PRO . . . . . 0.463 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 6.0 Cg_exo -78.31 149.07 24.43 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.964 2.443 . . . . 0.0 111.249 173.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 103' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.0 Cg_exo -77.87 148.83 25.57 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.21 1.94 . . . . 0.0 111.57 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 56.1 tp -78.08 148.77 34.09 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' P' P ' 105' ' ' ILE . . . . . 0.826 HD12 ' H ' ' P' ' 105' ' ' ILE . 1.1 mp -78.31 148.95 75.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.515 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 106' ' ' PRO . . . . . 0.604 ' CD ' ' HB2' ' W' ' 28' ' ' SER . 73.0 Cg_endo -78.18 148.86 24.65 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.195 2.597 . . . . 0.0 109.663 160.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 107' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' P' ' 106' ' ' PRO . 3.2 Cg_exo -77.98 148.76 25.17 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.021 1.148 . . . . 0.0 111.535 177.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 C--N 1.345 0.387 0 C-N-CA 122.461 2.107 . . . . 0.0 112.717 179.7 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.648 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.13 145.41 53.38 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.899 0.38 . . . . 0.0 110.393 175.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 7.0 p -86.61 101.97 13.74 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.109 0.481 . . . . 0.0 110.07 177.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.28 145.44 55.15 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.668 -0.696 . . . . 0.0 111.813 -174.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 4.5 m -82.62 116.52 26.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 121.297 0.57 . . . . 0.0 110.546 175.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' W' W ' 6' ' ' SER . . . . . 0.439 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.7 t -169.9 -148.2 0.06 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.201 -0.908 . . . . 0.0 108.71 -175.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 7' ' ' GLU . . . . . 0.729 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 35.8 mt-10 71.8 77.81 0.16 Allowed 'General case' 0 C--N 1.322 -0.622 0 O-C-N 124.472 1.108 . . . . 0.0 108.721 -178.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 8' ' ' TRP . . . . . 0.696 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 27.4 m95 -124.5 111.55 15.83 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.897 -173.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 9' ' ' THR . . . . . 0.521 HG23 ' HB3' ' W' ' 21' ' ' TYR . 2.2 t -99.69 -174.4 2.7 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 122.413 1.101 . . . . 0.0 110.468 177.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 10' ' ' GLU . . . . . 0.515 ' N ' ' OG1' ' W' ' 9' ' ' THR . 16.7 mt-10 -110.99 122.28 47.48 Favored 'General case' 0 C--N 1.288 -2.088 0 CA-C-N 112.431 -2.168 . . . . 0.0 109.846 -176.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 11' ' ' TYR . . . . . 0.543 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 1.9 m-85 -128.83 115.59 18.14 Favored 'General case' 0 C--N 1.313 -1.015 0 CA-C-O 121.407 0.623 . . . . 0.0 110.046 175.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -96.9 120.63 37.6 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.067 -176.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' W' W ' 13' ' ' THR . . . . . 0.412 ' OG1' ' HB3' ' W' ' 17' ' ' LYS . 16.4 p -90.71 165.66 13.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.334 175.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.35 -18.4 61.38 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -171.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' W' W ' 15' ' ' ASP . . . . . 0.448 ' OD2' ' HB2' ' W' ' 17' ' ' LYS . 6.3 p-10 -84.73 -3.19 58.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.89 0.376 . . . . 0.0 110.954 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 86.06 32.39 17.59 Favored Glycine 0 C--N 1.331 0.295 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.881 179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' W' W ' 17' ' ' LYS . . . . . 0.448 ' HB2' ' OD2' ' W' ' 15' ' ' ASP . 14.7 tppt? -97.86 130.21 44.78 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 -177.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.7 m -86.7 94.06 9.4 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 173.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' W' W ' 19' ' ' TYR . . . . . 0.625 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.0 OUTLIER -108.11 157.58 18.15 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -179.748 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' W' W ' 20' ' ' TYR . . . . . 0.699 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 85.5 m-85 -107.98 145.55 33.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.556 0.693 . . . . 0.0 110.232 -173.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 21' ' ' TYR . . . . . 0.521 ' HB3' HG23 ' W' ' 9' ' ' THR . 40.8 t80 -117.53 101.71 8.59 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 -179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 22' ' ' ASN . . . . . 0.696 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.3 t-20 -56.92 113.83 1.84 Allowed 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 113.602 -1.636 . . . . 0.0 110.434 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 23' ' ' ASN . . . . . 0.729 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 5.9 t30 -92.28 -7.28 48.51 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 24' ' ' ARG . . . . . 0.45 ' HB3' HD21 ' W' ' 22' ' ' ASN . 0.5 OUTLIER -54.89 -60.63 3.1 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.855 -1.066 . . . . 0.0 110.226 -176.369 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' W' W ' 25' ' ' THR . . . . . 0.411 HG23 ' HD2' ' W' ' 24' ' ' ARG . 10.1 p -132.24 20.73 4.42 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.393 178.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 26' ' ' LEU . . . . . 0.412 ' HA ' HD22 ' W' ' 26' ' ' LEU . 0.5 OUTLIER 65.1 81.92 0.2 Allowed 'General case' 0 CA--C 1.531 0.233 0 O-C-N 123.79 0.681 . . . . 0.0 110.265 -174.919 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' W' W ' 27' ' ' GLU . . . . . 0.477 ' HB3' ' CB ' ' W' ' 22' ' ' ASN . 9.9 tp10 -141.96 166.37 24.91 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.047 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 28' ' ' SER . . . . . 0.477 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -114.35 149.83 35.49 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 122.077 -0.389 . . . . 0.0 111.008 174.648 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' W' W ' 29' ' ' THR . . . . . 0.699 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 15.0 p -143.43 138.53 29.39 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 172.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 30' ' ' TRP . . . . . 0.625 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 90.4 m95 -70.21 -70.78 0.27 Allowed 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 120.501 -0.48 . . . . 0.0 110.682 178.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -105.0 -160.65 0.77 Allowed 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.834 -0.346 . . . . 0.0 110.88 -179.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 32' ' ' LYS . . . . . 0.433 ' HA ' ' HD3' ' W' ' 33' ' ' PRO . 97.3 mttt -57.39 128.68 79.26 Favored Pre-proline 0 C--O 1.231 0.117 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -175.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 33' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' W' ' 36' ' ' LEU . 74.3 Cg_exo -64.59 -178.82 0.76 Allowed 'Trans proline' 0 CA--C 1.537 0.639 0 C-N-CA 124.51 3.474 . . . . 0.0 113.594 170.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -72.23 -52.29 17.11 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.426 -177.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -80.0 -23.48 41.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.887 0.375 . . . . 0.0 111.372 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' W' W ' 36' ' ' LEU . . . . . 0.558 HD22 ' CD1' ' W' ' 8' ' ' TRP . 12.8 tp -84.87 101.45 12.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.564 176.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 46.9 mttp . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.445 -0.788 . . . . 0.0 110.692 -167.89 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo . . . . . 0 N--CA 1.481 0.783 0 N-CA-C 109.464 -1.014 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' P' P ' 102' ' ' PRO . . . . . 0.503 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 72.5 Cg_endo -77.99 148.66 25.05 Favored 'Trans proline' 0 N--CA 1.461 -0.437 0 C-N-CA 121.51 1.473 . . . . 0.0 113.061 -177.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 103' ' ' PRO . . . . . 0.503 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.6 Cg_exo -78.22 148.94 24.6 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.958 3.106 . . . . 0.0 111.543 171.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 104' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' P' ' 104' ' ' LEU . 4.3 mm? -78.12 148.63 34.09 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 167.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 105' ' ' ILE . . . . . 0.704 HG22 ' O ' ' P' ' 106' ' ' PRO . 2.0 mp -78.48 148.56 73.82 Favored Pre-proline 0 C--N 1.322 -0.592 0 C-N-CA 120.333 -0.547 . . . . 0.0 109.681 176.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.704 ' O ' HG22 ' P' ' 105' ' ' ILE . 71.7 Cg_endo -78.16 148.69 24.57 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 121.825 1.683 . . . . 0.0 110.396 163.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 107' ' ' PRO . . . . . 0.489 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 5.7 Cg_exo -78.07 148.84 24.98 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 121.163 1.242 . . . . 0.0 111.878 177.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 108' ' ' PRO . . . . . 0.489 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 2.8 Cg_exo -78.1 149.06 25.1 Favored 'Trans proline' 0 N--CA 1.458 -0.587 0 C-N-CA 122.731 2.288 . . . . 0.0 111.083 171.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 109' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 4.1 Cg_exo . . . . . 0 C--O 1.247 0.947 0 C-N-CA 122.705 2.27 . . . . 0.0 111.69 176.006 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 112.141 -0.384 . . . . 0.0 112.141 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.99 177.67 7.62 Favored 'General case' 0 C--N 1.327 -0.393 0 O-C-N 122.743 -0.269 . . . . 0.0 110.793 178.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 6.8 p -123.09 160.46 26.35 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.761 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -83.32 96.21 8.43 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.731 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 14.9 m -107.5 92.23 2.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 CA-C-O 121.389 0.614 . . . . 0.0 110.899 178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 6' ' ' SER . . . . . . . . . . . . . 21.3 t 178.12 -149.77 0.01 OUTLIER 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.306 -0.861 . . . . 0.0 109.391 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 7' ' ' GLU . . . . . 0.406 ' HB3' ' HB2' ' W' ' 23' ' ' ASN . 46.2 mt-10 72.85 85.26 0.12 Allowed 'General case' 0 N--CA 1.448 -0.554 0 O-C-N 124.637 1.21 . . . . 0.0 109.538 -176.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 8' ' ' TRP . . . . . 0.626 ' CZ3' ' ND2' ' W' ' 22' ' ' ASN . 47.3 m95 -124.29 134.89 53.09 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 113.745 -1.57 . . . . 0.0 110.041 -176.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 9' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 1.5 t -121.32 -179.19 3.99 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 122.414 1.102 . . . . 0.0 110.702 174.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 10' ' ' GLU . . . . . 0.497 ' N ' ' OG1' ' W' ' 9' ' ' THR . 38.4 mt-10 -112.05 119.46 38.54 Favored 'General case' 0 C--N 1.291 -1.948 0 CA-C-N 112.515 -2.13 . . . . 0.0 109.492 -178.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -123.73 88.59 2.94 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.817 0.817 . . . . 0.0 109.554 175.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -80.24 107.3 12.92 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.887 177.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 70.8 p -74.86 173.61 10.38 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 121.054 0.454 . . . . 0.0 111.78 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.5 -18.08 64.31 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.996 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -70.4 -23.09 62.7 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.883 177.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.18 29.93 10.77 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.668 -175.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 37.1 tptt -107.19 131.98 53.56 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 -176.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.2 m -87.41 97.97 11.11 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.701 0.286 . . . . 0.0 110.37 174.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 19' ' ' TYR . . . . . 0.608 ' CD2' HD11 ' P' ' 105' ' ' ILE . 0.2 OUTLIER -118.31 161.87 19.21 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 177.102 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' W' W ' 20' ' ' TYR . . . . . 0.681 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 52.8 m-85 -107.66 144.5 34.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.99 -176.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 21' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -117.16 126.17 52.38 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 22' ' ' ASN . . . . . 0.862 ' ND2' ' H ' ' W' ' 24' ' ' ARG . 3.9 t-20 -91.17 120.62 32.26 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-N 114.024 -1.444 . . . . 0.0 111.396 -170.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 23' ' ' ASN . . . . . 0.406 ' HB2' ' HB3' ' W' ' 7' ' ' GLU . 19.5 m120 -91.58 2.41 56.47 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.228 -0.442 . . . . 0.0 109.868 172.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 24' ' ' ARG . . . . . 0.862 ' H ' ' ND2' ' W' ' 22' ' ' ASN . 60.9 ttt180 -59.94 -68.3 0.3 Allowed 'General case' 0 C--N 1.345 0.409 0 CA-C-O 121.664 0.745 . . . . 0.0 110.573 -178.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 25' ' ' THR . . . . . 0.618 HG23 ' HG2' ' W' ' 24' ' ' ARG . 21.9 p -126.47 21.66 7.15 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.972 -1.013 . . . . 0.0 109.577 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 4.5 mm? 63.92 76.03 0.37 Allowed 'General case' 0 C--O 1.234 0.277 0 CA-C-N 114.76 -1.109 . . . . 0.0 110.117 -173.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 27' ' ' GLU . . . . . 0.471 ' HG3' ' N ' ' W' ' 28' ' ' SER . 5.5 tp10 -127.76 159.0 36.13 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.457 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 28' ' ' SER . . . . . 0.646 ' HB3' HG23 ' P' ' 105' ' ' ILE . 0.1 OUTLIER -114.59 151.46 33.41 Favored 'General case' 0 C--N 1.309 -1.188 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 171.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' W' W ' 29' ' ' THR . . . . . 0.681 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 11.3 p -143.55 131.25 21.33 Favored 'General case' 0 C--O 1.22 -0.458 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 177.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 30' ' ' TRP . . . . . 0.568 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 94.7 m95 -69.92 -50.49 41.65 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.01 0.433 . . . . 0.0 110.222 178.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -105.41 -167.97 1.4 Allowed 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.001 179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -77.81 140.38 62.95 Favored Pre-proline 0 N--CA 1.454 -0.269 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.448 -174.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 33' ' ' PRO . . . . . 0.953 ' HD2' HD23 ' W' ' 36' ' ' LEU . 54.0 Cg_exo -64.35 161.5 34.28 Favored 'Trans proline' 0 N--CA 1.474 0.364 0 C-N-CA 123.383 2.722 . . . . 0.0 112.231 170.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -95.82 -17.82 20.86 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.028 0.442 . . . . 0.0 110.568 178.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' W' W ' 35' ' ' GLU . . . . . 0.408 ' H ' ' HG2' ' W' ' 35' ' ' GLU . 4.3 pt-20 -80.93 -9.71 59.8 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.714 0.768 . . . . 0.0 109.038 170.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 36' ' ' LEU . . . . . 0.953 HD23 ' HD2' ' W' ' 33' ' ' PRO . 24.2 tp -101.88 113.25 26.28 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.978 174.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 26.0 mmtp . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.436 -0.792 . . . . 0.0 110.42 -173.667 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo . . . . . 0 N--CA 1.477 0.512 0 N-CA-C 109.602 -0.961 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' P' P ' 102' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.3 Cg_endo -78.02 148.94 25.21 Favored 'Trans proline' 0 CA--C 1.529 0.246 0 C-N-CA 122.393 2.062 . . . . 0.0 111.987 177.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 103' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.4 Cg_exo -78.12 148.57 24.58 Favored 'Trans proline' 0 N--CA 1.46 -0.479 0 C-N-CA 122.589 2.193 . . . . 0.0 112.01 177.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 104' ' ' LEU . . . . . 0.687 ' H ' HD23 ' P' ' 104' ' ' LEU . 2.4 pt? -77.91 148.79 34.39 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 173.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 105' ' ' ILE . . . . . 0.646 HG23 ' HB3' ' W' ' 28' ' ' SER . 2.0 mp -78.34 148.78 74.7 Favored Pre-proline 0 C--N 1.319 -0.738 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 170.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.623 ' O ' HG22 ' P' ' 105' ' ' ILE . 72.4 Cg_endo -78.19 148.92 24.68 Favored 'Trans proline' 0 N--CA 1.456 -0.68 0 C-N-CA 121.176 1.25 . . . . 0.0 110.477 163.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -78.38 149.15 24.29 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.334 2.023 . . . . 0.0 111.544 172.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' P' P ' 108' ' ' PRO . . . . . 0.485 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 73.9 Cg_endo -77.75 148.95 26.04 Favored 'Trans proline' 0 N--CA 1.46 -0.482 0 C-N-CA 121.877 1.718 . . . . 0.0 111.167 177.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 109' ' ' PRO . . . . . 0.485 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 6.1 Cg_exo . . . . . 0 C--O 1.246 0.893 0 C-N-CA 122.794 2.329 . . . . 0.0 112.032 -174.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.768 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . 70.43 93.52 0.08 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-O 121.486 0.66 . . . . 0.0 110.714 -177.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 31.4 p -86.34 22.71 1.75 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.304 -174.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.09 104.05 6.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.987 0.423 . . . . 0.0 111.534 -177.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 59.3 t -99.48 90.64 2.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 173.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 6' ' ' SER . . . . . 0.535 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 96.9 p -169.57 -157.15 0.16 Allowed 'General case' 0 N--CA 1.435 -1.2 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 -175.254 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 73.68 77.79 0.13 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -172.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 8' ' ' TRP . . . . . 0.623 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 43.5 m95 -124.03 125.94 45.4 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.282 -174.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 9' ' ' THR . . . . . 0.478 ' OG1' ' N ' ' W' ' 10' ' ' GLU . 9.9 t -115.98 -171.63 2.02 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.617 1.199 . . . . 0.0 110.513 173.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 10' ' ' GLU . . . . . 0.606 ' HB3' ' HE3' ' W' ' 12' ' ' LYS . 40.4 mt-10 -112.33 122.13 46.84 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 112.183 -2.28 . . . . 0.0 110.372 -178.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -127.37 107.22 9.78 Favored 'General case' 0 C--N 1.311 -1.103 0 CA-C-O 121.417 0.627 . . . . 0.0 110.396 176.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 12' ' ' LYS . . . . . 0.606 ' HE3' ' HB3' ' W' ' 10' ' ' GLU . 0.0 OUTLIER -100.61 118.39 36.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.327 -178.799 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.6 p -75.0 168.24 20.36 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.673 -176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.42 -23.76 66.35 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 112.307 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -85.14 -10.63 56.53 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.004 0.43 . . . . 0.0 110.441 178.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.86 58.81 1.15 Allowed Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 115.966 -0.561 . . . . 0.0 113.007 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 17' ' ' LYS . . . . . 0.58 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.7 mmtm -119.14 144.0 46.89 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 96.9 m -99.34 95.71 7.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.275 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 19' ' ' TYR . . . . . 0.742 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.35 165.69 13.55 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 120.671 -0.412 . . . . 0.0 109.915 175.768 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' W' W ' 20' ' ' TYR . . . . . 0.623 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 42.2 m-85 -107.67 144.69 34.39 Favored 'General case' 0 CA--C 1.509 -0.625 0 CA-C-O 121.261 0.553 . . . . 0.0 109.822 -175.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 21' ' ' TYR . . . . . . . . . . . . . 41.6 t80 -117.3 99.34 6.95 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 122.337 1.065 . . . . 0.0 108.44 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 22' ' ' ASN . . . . . 0.757 HD21 ' H ' ' W' ' 25' ' ' THR . 4.3 t30 -57.17 101.65 0.07 Allowed 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 112.737 -2.029 . . . . 0.0 110.944 -177.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -84.31 -1.52 55.5 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 173.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 24' ' ' ARG . . . . . 0.723 ' HB3' ' OD1' ' W' ' 22' ' ' ASN . 19.7 ttp180 -56.36 -61.41 2.42 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.893 177.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 25' ' ' THR . . . . . 0.757 ' H ' HD21 ' W' ' 22' ' ' ASN . 5.2 p -132.4 19.35 4.37 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.612 -179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 26' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' W' ' 26' ' ' LEU . 0.5 OUTLIER 63.96 81.82 0.2 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.527 0.68 . . . . 0.0 109.8 -173.268 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' W' W ' 27' ' ' GLU . . . . . 0.587 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.2 tp10 -142.3 165.64 26.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.207 -0.906 . . . . 0.0 109.215 -178.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 28' ' ' SER . . . . . 0.552 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 14.8 m -114.75 151.92 32.93 Favored 'General case' 0 C--N 1.31 -1.125 0 CA-C-O 120.523 0.201 . . . . 0.0 111.535 173.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 29' ' ' THR . . . . . 0.623 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 10.5 p -143.84 137.02 27.65 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.428 -0.953 . . . . 0.0 108.428 172.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 30' ' ' TRP . . . . . 0.795 ' CH2' HD13 ' P' ' 105' ' ' ILE . 80.1 m95 -69.84 -57.99 4.41 Favored 'General case' 0 C--N 1.319 -0.718 0 O-C-N 121.774 -0.579 . . . . 0.0 110.459 176.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 17.2 mp0 -105.17 -174.06 2.45 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.994 -176.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 32' ' ' LYS . . . . . 0.476 ' HD3' ' OXT' ' W' ' 37' ' ' LYS . 60.3 mttp -52.74 142.46 33.06 Favored Pre-proline 0 C--O 1.238 0.493 0 CA-C-N 115.454 -0.793 . . . . 0.0 112.751 -178.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 33' ' ' PRO . . . . . 0.509 ' HG2' HD23 ' W' ' 36' ' ' LEU . 46.1 Cg_exo -64.84 -165.79 0.08 OUTLIER 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.013 3.142 . . . . 0.0 113.256 171.89 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -92.61 -40.76 10.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.569 -172.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' W' W ' 35' ' ' GLU . . . . . 0.415 ' H ' ' CD ' ' W' ' 35' ' ' GLU . 0.0 OUTLIER -97.22 -28.3 14.14 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.025 178.663 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' W' W ' 36' ' ' LEU . . . . . 0.509 HD23 ' HG2' ' W' ' 33' ' ' PRO . 24.7 tp -77.25 84.91 3.7 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.405 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' W' W ' 37' ' ' LYS . . . . . 0.476 ' OXT' ' HD3' ' W' ' 32' ' ' LYS . 56.1 mttp . . . . . 0 C--O 1.249 1.046 0 CA-C-N 114.781 -1.1 . . . . 0.0 112.101 174.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo . . . . . 0 N--CA 1.479 0.653 0 N-CA-C 110.205 -0.729 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' P' P ' 102' ' ' PRO . . . . . 0.514 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 73.9 Cg_endo -77.82 148.74 25.62 Favored 'Trans proline' 0 N--CA 1.459 -0.55 0 C-N-CA 122.44 2.093 . . . . 0.0 112.239 177.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 103' ' ' PRO . . . . . 0.514 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 9.9 Cg_exo -77.69 148.87 26.14 Favored 'Trans proline' 0 N--CA 1.459 -0.556 0 C-N-CA 123.422 2.748 . . . . 0.0 111.637 174.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 82.1 mt -78.28 148.98 33.64 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 171.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 105' ' ' ILE . . . . . 0.795 HD13 ' CH2' ' W' ' 30' ' ' TRP . 2.1 mp -77.87 148.97 76.6 Favored Pre-proline 0 C--N 1.32 -0.689 0 C-N-CA 120.251 -0.579 . . . . 0.0 109.513 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.552 ' CD ' ' HB2' ' W' ' 28' ' ' SER . 72.1 Cg_endo -78.13 148.6 24.58 Favored 'Trans proline' 0 N--CA 1.458 -0.613 0 C-N-CA 121.698 1.599 . . . . 0.0 109.944 165.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 107' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -78.32 148.94 24.32 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.609 2.206 . . . . 0.0 112.872 173.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 108' ' ' PRO . . . . . 0.419 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 74.3 Cg_endo -77.95 148.79 25.29 Favored 'Trans proline' 0 N--CA 1.457 -0.618 0 C-N-CA 122.025 1.817 . . . . 0.0 109.617 166.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 109' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 6.0 Cg_exo . . . . . 0 C--O 1.246 0.88 0 C-N-CA 122.4 2.067 . . . . 0.0 112.729 -178.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.686 0 N-CA-C 111.937 -0.465 . . . . 0.0 111.937 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.27 -18.27 13.63 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.063 0.458 . . . . 0.0 109.942 173.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 14.7 t -155.86 165.83 35.3 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . 66.92 175.62 0.25 Allowed 'General case' 0 N--CA 1.465 0.278 0 O-C-N 123.723 0.639 . . . . 0.0 111.435 -176.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 17.5 t 54.61 64.72 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.473 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 6' ' ' SER . . . . . 0.544 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 52.8 m -169.12 -171.64 1.35 Allowed 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 -177.567 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 7' ' ' GLU . . . . . 0.666 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 39.6 mm-40 67.77 80.45 0.21 Allowed 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 -170.392 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 8' ' ' TRP . . . . . 0.804 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 25.2 m95 -124.61 111.24 15.4 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.339 -0.846 . . . . 0.0 110.716 -170.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 9' ' ' THR . . . . . 0.476 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.6 OUTLIER -99.91 172.39 7.26 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.812 1.291 . . . . 0.0 111.5 175.814 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' W' W ' 10' ' ' GLU . . . . . 0.476 ' N ' ' OG1' ' W' ' 9' ' ' THR . 8.4 pt-20 -108.57 119.89 40.83 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 112.012 -2.358 . . . . 0.0 110.225 -178.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -124.48 105.34 9.32 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.527 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -88.13 115.15 25.41 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.575 179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 17.5 p -79.83 170.24 16.78 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.736 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.78 -16.84 62.22 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.779 -175.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -84.94 0.18 52.11 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.259 179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 77.86 26.35 60.65 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.001 -0.619 . . . . 0.0 111.71 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -105.47 124.95 50.41 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 -178.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 91.9 m -86.91 106.34 17.71 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 19' ' ' TYR . . . . . 0.649 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.7 OUTLIER -109.59 163.91 13.02 Favored 'General case' 0 N--CA 1.447 -0.604 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.588 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' W' W ' 20' ' ' TYR . . . . . 0.629 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 32.8 m-85 -107.67 141.55 39.0 Favored 'General case' 0 C--N 1.311 -1.105 0 CA-C-O 121.366 0.603 . . . . 0.0 109.868 -176.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 21' ' ' TYR . . . . . 0.476 ' HB3' HG23 ' W' ' 9' ' ' THR . 51.7 t80 -117.39 94.72 4.66 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 107.34 -1.355 . . . . 0.0 107.34 -177.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 22' ' ' ASN . . . . . 0.804 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 2.4 t-20 -51.19 109.04 0.29 Allowed 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.056 -1.883 . . . . 0.0 110.461 -178.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 23' ' ' ASN . . . . . 0.666 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 65.0 t30 -91.7 5.8 48.34 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 174.374 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.95 -64.61 0.86 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.269 176.572 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 10.0 t -131.93 17.3 4.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.645 -178.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 26' ' ' LEU . . . . . 0.437 HD13 ' HA ' ' W' ' 26' ' ' LEU . 4.1 mm? 67.24 61.35 0.48 Allowed 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 122.363 1.078 . . . . 0.0 110.919 -177.303 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 27' ' ' GLU . . . . . 0.587 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 2.4 tt0 -112.99 160.79 17.75 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 113.622 -1.626 . . . . 0.0 109.465 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 28' ' ' SER . . . . . 0.556 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 34.4 m -114.45 147.4 39.34 Favored 'General case' 0 C--N 1.312 -1.035 0 O-C-N 122.05 -0.406 . . . . 0.0 111.404 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 29' ' ' THR . . . . . 0.629 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 3.2 p -143.45 137.21 28.43 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 30' ' ' TRP . . . . . 0.666 ' CD1' HG21 ' P' ' 105' ' ' ILE . 72.3 m95 -72.15 -61.88 1.63 Allowed 'General case' 0 C--O 1.224 -0.281 0 O-C-N 121.729 -0.607 . . . . 0.0 110.652 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 31' ' ' GLU . . . . . 0.525 ' OE1' ' HG2' ' W' ' 32' ' ' LYS . 3.0 pt-20 -105.63 -161.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 119.347 -0.941 . . . . 0.0 111.138 172.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 32' ' ' LYS . . . . . 0.525 ' HG2' ' OE1' ' W' ' 31' ' ' GLU . 9.8 ptpp? -61.42 139.54 94.86 Favored Pre-proline 0 C--O 1.234 0.275 0 CA-C-O 121.983 0.897 . . . . 0.0 113.055 -167.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 33' ' ' PRO . . . . . 0.65 ' HD2' HD23 ' W' ' 36' ' ' LEU . 71.5 Cg_exo -64.53 -178.62 0.71 Allowed 'Trans proline' 0 CA--C 1.534 0.483 0 C-N-CA 124.41 3.407 . . . . 0.0 114.116 172.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -51.36 -72.63 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 114.741 -1.118 . . . . 0.0 112.57 -175.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -94.5 3.46 55.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.452 -172.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' W' W ' 36' ' ' LEU . . . . . 0.65 HD23 ' HD2' ' W' ' 33' ' ' PRO . 6.5 tp -87.63 95.19 9.96 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.68 0.753 . . . . 0.0 109.775 177.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 19.2 pttm . . . . . 0 C--O 1.244 0.783 0 CA-C-N 114.765 -1.107 . . . . 0.0 109.726 179.962 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' P' P ' 101' ' ' PRO . . . . . 0.43 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 7.2 Cg_exo . . . . . 0 N--CA 1.481 0.737 0 N-CA-C 109.992 -0.811 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 102' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.51 148.99 23.79 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 122.38 2.053 . . . . 0.0 111.98 -177.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 103' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.1 Cg_exo -78.12 148.51 24.54 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 122.852 2.368 . . . . 0.0 112.379 178.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 96.4 mt -77.7 148.76 34.79 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 169.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' P' P ' 105' ' ' ILE . . . . . 0.666 HG21 ' CD1' ' W' ' 30' ' ' TRP . 2.0 mp -77.88 148.97 76.53 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 173.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.66 ' O ' HG22 ' P' ' 105' ' ' ILE . 73.2 Cg_endo -78.34 148.81 24.13 Favored 'Trans proline' 0 N--CA 1.456 -0.704 0 C-N-CA 121.614 1.542 . . . . 0.0 109.614 166.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 107' ' ' PRO . . . . . 0.523 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 73.7 Cg_endo -78.39 149.12 24.25 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 121.332 1.355 . . . . 0.0 113.14 179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 108' ' ' PRO . . . . . 0.523 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 3.8 Cg_exo -78.27 149.2 24.68 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 123.055 2.503 . . . . 0.0 111.601 172.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 109' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo . . . . . 0 C--O 1.25 1.111 0 C-N-CA 122.699 2.266 . . . . 0.0 111.369 175.831 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.821 0 N-CA-C 111.616 -0.594 . . . . 0.0 111.616 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.81 -26.72 11.64 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 120.814 0.34 . . . . 0.0 111.029 -177.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 9.7 t -83.36 125.73 31.97 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.27 0.557 . . . . 0.0 110.323 179.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.94 164.93 12.9 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.473 179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 5' ' ' VAL . . . . . 0.431 ' O ' ' HB2' ' W' ' 6' ' ' SER . 28.8 m -126.74 160.73 34.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.508 -0.314 . . . . 0.0 110.696 -179.188 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 6' ' ' SER . . . . . 0.533 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 33.1 t 171.09 -153.69 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 177.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 7' ' ' GLU . . . . . 0.545 ' OE1' ' HD2' ' W' ' 24' ' ' ARG . 27.7 mt-10 63.0 79.89 0.25 Allowed 'General case' 0 N--CA 1.444 -0.725 0 CA-C-O 122.173 0.987 . . . . 0.0 108.808 -176.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 8' ' ' TRP . . . . . 0.647 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 36.0 m95 -124.08 124.73 43.17 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.064 -1.426 . . . . 0.0 110.833 -172.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 9' ' ' THR . . . . . 0.688 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.2 OUTLIER -112.43 176.84 4.85 Favored 'General case' 0 CA--C 1.502 -0.89 0 CA-C-O 122.117 0.961 . . . . 0.0 111.13 174.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' W' W ' 10' ' ' GLU . . . . . 0.487 ' N ' ' OG1' ' W' ' 9' ' ' THR . 43.3 mt-10 -111.95 118.9 36.76 Favored 'General case' 0 C--N 1.296 -1.726 0 CA-C-N 113.047 -1.888 . . . . 0.0 109.822 -179.555 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -123.96 119.12 28.66 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.215 -0.902 . . . . 0.0 109.837 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 12' ' ' LYS . . . . . 0.585 ' H ' ' HD2' ' W' ' 12' ' ' LYS . 0.0 OUTLIER -104.18 123.68 47.74 Favored 'General case' 0 C--N 1.319 -0.751 0 C-N-CA 120.538 -0.465 . . . . 0.0 109.766 176.86 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 10.8 p -82.21 177.0 9.03 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.0 -178.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.87 -26.86 62.67 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -175.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 15' ' ' ASP . . . . . 0.409 ' OD2' ' HG2' ' W' ' 17' ' ' LYS . 19.1 t70 -76.83 -28.16 55.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.499 -178.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 104.78 29.27 5.34 Favored Glycine 0 N--CA 1.448 -0.51 0 N-CA-C 111.299 -0.721 . . . . 0.0 111.299 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 17' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 40.9 mmtm -96.74 123.34 40.4 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.468 -0.366 . . . . 0.0 110.402 178.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 51.9 m -86.53 106.37 17.48 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.357 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 19' ' ' TYR . . . . . 0.746 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 2.5 p90 -117.98 169.62 9.5 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 121.037 0.446 . . . . 0.0 110.306 175.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 20' ' ' TYR . . . . . 0.584 ' HB2' HG23 ' W' ' 29' ' ' THR . 34.9 m-85 -107.8 139.42 42.41 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.927 -177.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 21' ' ' TYR . . . . . 0.688 ' HB3' HG23 ' W' ' 9' ' ' THR . 58.6 t80 -116.98 99.12 6.86 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.045 -1.095 . . . . 0.0 108.045 -175.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 22' ' ' ASN . . . . . 0.647 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 7.9 t-20 -56.62 108.87 0.54 Allowed 'General case' 0 C--N 1.312 -1.052 0 CA-C-N 112.979 -1.919 . . . . 0.0 110.27 -177.28 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -89.97 4.44 50.08 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 171.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 24' ' ' ARG . . . . . 0.577 ' HB3' HD21 ' W' ' 22' ' ' ASN . 23.6 tpt180 -63.75 -63.67 1.1 Allowed 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.697 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 25' ' ' THR . . . . . . . . . . . . . 16.6 p -130.44 20.84 5.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.267 177.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 67.1 85.36 0.14 Allowed 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 114.707 -1.133 . . . . 0.0 110.279 -175.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 27' ' ' GLU . . . . . 0.51 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 7.0 tp10 -142.17 160.29 40.53 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.017 -0.992 . . . . 0.0 109.172 179.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 28' ' ' SER . . . . . 0.572 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 6.3 m -114.54 140.11 49.03 Favored 'General case' 0 C--N 1.31 -1.128 0 O-C-N 122.261 -0.274 . . . . 0.0 110.718 172.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 29' ' ' THR . . . . . 0.584 HG23 ' HB2' ' W' ' 20' ' ' TYR . 1.7 t -144.23 136.37 26.4 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.521 176.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 30' ' ' TRP . . . . . 0.746 ' HA ' ' HB2' ' W' ' 19' ' ' TYR . 89.9 m95 -69.88 -70.69 0.27 Allowed 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 120.704 0.288 . . . . 0.0 110.822 -174.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 49.1 mp0 -86.94 -177.15 5.99 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.27 0.557 . . . . 0.0 111.054 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 32' ' ' LYS . . . . . 0.498 ' HD2' ' HB2' ' W' ' 37' ' ' LYS . 25.3 pttm -69.62 147.39 96.55 Favored Pre-proline 0 N--CA 1.446 -0.626 0 CA-C-N 115.256 -0.883 . . . . 0.0 111.678 -174.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 33' ' ' PRO . . . . . 0.652 ' HD2' HD23 ' W' ' 36' ' ' LEU . 53.4 Cg_exo -64.71 163.94 25.87 Favored 'Trans proline' 0 C--N 1.336 -0.113 0 C-N-CA 123.573 2.848 . . . . 0.0 113.003 175.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -71.31 -27.66 63.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.147 -175.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -91.09 -20.52 21.95 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.455 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 36' ' ' LEU . . . . . 0.652 HD23 ' HD2' ' W' ' 33' ' ' PRO . 9.7 tp -97.1 101.65 13.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.811 -173.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' W' W ' 37' ' ' LYS . . . . . 0.498 ' HB2' ' HD2' ' W' ' 32' ' ' LYS . 27.9 mtpp . . . . . 0 C--O 1.245 0.828 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.591 -179.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 101' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 10.2 Cg_endo . . . . . 0 N--CA 1.478 0.604 0 N-CA-C 111.072 -0.396 . . . . 0.0 111.072 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 102' ' ' PRO . . . . . 0.45 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.3 Cg_exo -77.71 148.65 25.87 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.946 2.431 . . . . 0.0 111.06 176.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 103' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.63 148.56 26.04 Favored 'Trans proline' 0 C--O 1.234 0.286 0 C-N-CA 122.377 2.052 . . . . 0.0 112.661 -178.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 87.5 mt -78.29 149.19 33.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.56 -0.746 . . . . 0.0 109.926 172.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' P' P ' 105' ' ' ILE . . . . . 0.667 HG21 ' CD1' ' W' ' 30' ' ' TRP . 1.8 mp -78.19 148.62 74.93 Favored Pre-proline 0 C--N 1.32 -0.684 0 C-N-CA 120.109 -0.636 . . . . 0.0 109.298 174.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.634 ' O ' HG22 ' P' ' 105' ' ' ILE . 73.0 Cg_endo -78.15 148.68 24.59 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.678 2.252 . . . . 0.0 111.126 164.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 107' ' ' PRO . . . . . 0.481 ' HD3' ' HA ' ' P' ' 106' ' ' PRO . 4.4 Cg_exo -78.28 148.9 24.4 Favored 'Trans proline' 0 N--CA 1.46 -0.473 0 C-N-CA 122.118 1.879 . . . . 0.0 111.093 171.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 108' ' ' PRO . . . . . 0.461 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 2.8 Cg_exo -77.58 148.53 26.16 Favored 'Trans proline' 0 N--CA 1.458 -0.614 0 C-N-CA 121.503 1.469 . . . . 0.0 111.383 176.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 109' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 5.7 Cg_exo . . . . . 0 C--O 1.249 1.053 0 C-N-CA 123.248 2.632 . . . . 0.0 112.491 177.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.728 0 CA-C-O 119.988 -0.34 . . . . 0.0 112.353 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . 73.97 3.38 4.42 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.536 0.735 . . . . 0.0 112.299 178.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 68.7 p 53.51 -173.87 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.868 0.867 . . . . 0.0 112.325 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . 68.17 81.42 0.19 Allowed 'General case' 0 C--O 1.235 0.333 0 C-N-CA 123.03 0.532 . . . . 0.0 111.269 177.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 m -70.49 109.11 2.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.66 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 6' ' ' SER . . . . . 0.531 ' O ' ' HB2' ' W' ' 7' ' ' GLU . 18.5 t -170.55 -153.57 0.1 Allowed 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.029 -0.532 . . . . 0.0 109.79 -177.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 7' ' ' GLU . . . . . 0.965 ' HB3' ' HB2' ' W' ' 23' ' ' ASN . 0.9 OUTLIER 74.51 79.04 0.11 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.381 1.051 . . . . 0.0 108.423 -171.64 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' W' W ' 8' ' ' TRP . . . . . 0.647 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 20.7 m95 -124.73 112.26 16.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.537 -1.21 . . . . 0.0 109.834 -172.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 9' ' ' THR . . . . . 0.934 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -100.01 167.41 10.51 Favored 'General case' 0 CA--C 1.498 -1.025 0 CA-C-O 122.331 1.062 . . . . 0.0 111.673 176.013 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' W' W ' 10' ' ' GLU . . . . . 0.412 ' H ' ' HG2' ' W' ' 10' ' ' GLU . 8.3 pt-20 -102.94 112.33 25.1 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 112.594 -2.094 . . . . 0.0 110.359 -176.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 11' ' ' TYR . . . . . 0.452 ' HB3' ' CE2' ' W' ' 19' ' ' TYR . 3.4 m-85 -124.01 110.15 14.42 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.07 -0.968 . . . . 0.0 111.009 -175.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 59.8 pttt -99.22 123.34 43.43 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.702 175.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 69.0 p -81.83 170.8 15.26 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.477 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -13.02 62.0 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -80.69 -16.7 53.29 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.654 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 95.07 25.8 13.72 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.06 -0.591 . . . . 0.0 111.744 -176.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.4 mmmt -104.35 124.24 48.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.544 0.211 . . . . 0.0 110.805 -179.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 87.7 m -87.04 103.57 15.5 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.72 175.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 19' ' ' TYR . . . . . 0.71 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 1.1 p90 -118.17 166.14 12.94 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.202 0.525 . . . . 0.0 110.653 179.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 20' ' ' TYR . . . . . 0.712 ' HB2' HG23 ' W' ' 29' ' ' THR . 35.8 m-85 -107.92 144.61 34.94 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.313 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 21' ' ' TYR . . . . . 0.934 ' HB3' HG23 ' W' ' 9' ' ' THR . 50.9 t80 -117.1 114.04 23.15 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -176.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 22' ' ' ASN . . . . . 0.758 ' OD1' ' HB3' ' W' ' 24' ' ' ARG . 4.8 t30 -74.68 101.95 4.44 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 113.801 -1.545 . . . . 0.0 110.767 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 23' ' ' ASN . . . . . 0.965 ' HB2' ' HB3' ' W' ' 7' ' ' GLU . 79.1 m-20 -80.81 -10.03 59.76 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 173.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 24' ' ' ARG . . . . . 0.758 ' HB3' ' OD1' ' W' ' 22' ' ' ASN . 15.4 ttp180 -49.9 -59.51 3.79 Favored 'General case' 0 N--CA 1.456 -0.156 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.125 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 25' ' ' THR . . . . . 0.73 ' H ' ' ND2' ' W' ' 22' ' ' ASN . 8.8 p -132.12 17.66 4.55 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.2 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 26' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 62.79 81.86 0.19 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.005 -172.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 27' ' ' GLU . . . . . 0.619 ' HB3' ' HB3' ' W' ' 22' ' ' ASN . 10.4 tp10 -142.03 167.53 21.91 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.54 -178.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 28' ' ' SER . . . . . 0.606 ' HB3' ' HD2' ' P' ' 106' ' ' PRO . 0.3 OUTLIER -114.58 143.48 44.93 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 110.276 -0.268 . . . . 0.0 110.276 172.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' W' W ' 29' ' ' THR . . . . . 0.712 HG23 ' HB2' ' W' ' 20' ' ' TYR . 1.5 t -144.05 137.08 27.37 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 173.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 30' ' ' TRP . . . . . 0.71 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 92.4 m95 -69.89 -82.14 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 120.661 0.267 . . . . 0.0 111.464 -174.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -105.24 -155.79 0.55 Allowed 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.371 -0.532 . . . . 0.0 110.897 -172.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 32' ' ' LYS . . . . . . . . . . . . . 61.1 mttm -53.12 115.82 8.21 Favored Pre-proline 0 N--CA 1.464 0.243 0 N-CA-C 113.677 0.992 . . . . 0.0 113.677 -168.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 33' ' ' PRO . . . . . 0.467 ' HB2' ' HB3' ' W' ' 36' ' ' LEU . 36.5 Cg_exo -65.09 148.31 89.2 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 123.203 2.602 . . . . 0.0 111.286 169.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 35.2 mt-30 -55.63 -37.93 68.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.763 0.316 . . . . 0.0 111.452 -178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -94.84 24.82 4.46 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.001 0.429 . . . . 0.0 111.174 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' W' W ' 36' ' ' LEU . . . . . 0.586 HD22 ' CD1' ' W' ' 8' ' ' TRP . 34.8 tp -156.45 43.2 0.39 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.011 0.91 . . . . 0.0 108.811 -179.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' W' W ' 37' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? . . . . . 0 C--O 1.251 1.171 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.597 -179.269 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' P' P ' 101' ' ' PRO . . . . . 0.497 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 1.7 Cg_endo . . . . . 0 N--CA 1.474 0.377 0 N-CA-C 110.187 -0.736 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 102' ' ' PRO . . . . . 0.497 ' HD3' ' HA ' ' P' ' 101' ' ' PRO . 4.9 Cg_exo -78.06 148.95 25.09 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.928 2.419 . . . . 0.0 111.99 178.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 103' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 2.8 Cg_exo -77.94 148.68 25.23 Favored 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 122.545 2.163 . . . . 0.0 111.629 175.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 104' ' ' LEU . . . . . 0.444 ' O ' HD12 ' P' ' 104' ' ' LEU . 3.5 pp -78.05 148.91 34.08 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.367 173.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 105' ' ' ILE . . . . . 0.624 HG22 ' O ' ' P' ' 106' ' ' PRO . 1.7 mp -78.45 148.81 74.37 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 174.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.624 ' O ' HG22 ' P' ' 105' ' ' ILE . 60.2 Cg_endo -78.14 148.88 24.79 Favored 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 122.07 1.846 . . . . 0.0 110.682 162.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 107' ' ' PRO . . . . . 0.457 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 72.6 Cg_endo -77.95 149.14 25.6 Favored 'Trans proline' 0 N--CA 1.459 -0.532 0 C-N-CA 121.625 1.55 . . . . 0.0 112.111 178.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 108' ' ' PRO . . . . . 0.494 ' HA ' ' HD3' ' P' ' 109' ' ' PRO . 5.6 Cg_exo -78.0 148.74 25.11 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.298 1.998 . . . . 0.0 112.106 -178.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 109' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' P' ' 108' ' ' PRO . 2.6 Cg_exo . . . . . 0 C--O 1.249 1.042 0 C-N-CA 123.372 2.715 . . . . 0.0 111.233 174.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.797 0 N-CA-C 112.164 -0.374 . . . . 0.0 112.164 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.21 151.98 50.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 13.2 t -167.71 178.93 5.05 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 -178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . 64.1 176.74 0.18 Allowed 'General case' 0 C--O 1.237 0.423 0 O-C-N 124.058 0.849 . . . . 0.0 112.1 177.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 5' ' ' VAL . . . . . 0.545 HG21 ' HB2' ' W' ' 34' ' ' GLN . 12.5 m -113.2 119.62 61.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-O 121.558 0.694 . . . . 0.0 110.841 174.088 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 6' ' ' SER . . . . . 0.767 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 21.1 t -169.83 -158.73 0.19 Allowed 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 -176.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 7' ' ' GLU . . . . . 0.417 ' HB3' ' HB3' ' W' ' 23' ' ' ASN . 6.2 mm-40 61.77 77.73 0.32 Allowed 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 -168.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 8' ' ' TRP . . . . . 0.786 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 45.1 m95 -124.19 124.74 43.12 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.464 -171.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 9' ' ' THR . . . . . 0.679 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -108.62 167.99 9.65 Favored 'General case' 0 CA--C 1.497 -1.092 0 CA-C-O 122.651 1.215 . . . . 0.0 111.89 175.567 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' W' W ' 10' ' ' GLU . . . . . 0.495 ' H ' ' CD ' ' W' ' 10' ' ' GLU . 0.7 OUTLIER -106.54 115.99 31.16 Favored 'General case' 0 C--N 1.29 -2.009 0 CA-C-N 111.838 -2.437 . . . . 0.0 110.455 -177.825 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -124.08 116.03 22.12 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.537 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 12' ' ' LYS . . . . . 0.44 ' HA ' ' O ' ' W' ' 17' ' ' LYS . 48.5 mtmt -103.69 113.24 26.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 77.2 p -79.92 173.98 12.04 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.161 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -71.88 -6.0 38.58 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.241 0.543 . . . . 0.0 111.102 -177.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -84.99 -3.66 58.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.648 -0.706 . . . . 0.0 109.766 178.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 78.8 28.24 55.09 Favored Glycine 0 N--CA 1.447 -0.629 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 -178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 17' ' ' LYS . . . . . 0.44 ' O ' ' HA ' ' W' ' 12' ' ' LYS . 47.3 mmtm -105.94 126.44 52.18 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.791 0.329 . . . . 0.0 110.761 -175.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 95.8 m -88.3 101.84 14.25 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.041 175.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 19' ' ' TYR . . . . . 0.652 ' HA ' ' O ' ' W' ' 30' ' ' TRP . 0.5 OUTLIER -115.64 163.52 15.68 Favored 'General case' 0 CA--C 1.515 -0.373 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.377 178.406 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' W' W ' 20' ' ' TYR . . . . . 0.633 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 26.9 m-85 -107.81 143.11 36.85 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-O 121.454 0.645 . . . . 0.0 109.763 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 21' ' ' TYR . . . . . 0.679 ' HB3' HG23 ' W' ' 9' ' ' THR . 58.1 t80 -117.24 100.94 8.04 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 22' ' ' ASN . . . . . 0.786 ' HB2' ' HZ3' ' W' ' 8' ' ' TRP . 3.8 t-20 -55.28 111.92 0.98 Allowed 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 113.724 -1.58 . . . . 0.0 110.52 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 23' ' ' ASN . . . . . 0.417 ' HB3' ' HB3' ' W' ' 7' ' ' GLU . 5.3 t-20 -98.52 5.02 48.27 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 173.054 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 24' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? -61.33 -65.51 0.68 Allowed 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.16 177.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 25' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' W' ' 26' ' ' LEU . 8.8 t -132.16 18.18 4.51 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.089 177.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 26' ' ' LEU . . . . . 0.42 ' HB2' ' O ' ' W' ' 25' ' ' THR . 4.3 mm? 71.06 85.04 0.13 Allowed 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.221 -177.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 27' ' ' GLU . . . . . 0.518 ' HB3' ' CG ' ' W' ' 22' ' ' ASN . 1.6 tt0 -141.66 161.24 38.41 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.63 -1.168 . . . . 0.0 109.224 -179.489 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 28' ' ' SER . . . . . 0.483 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 31.2 m -114.4 146.41 40.62 Favored 'General case' 0 C--N 1.311 -1.067 0 O-C-N 121.836 -0.54 . . . . 0.0 111.017 174.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 29' ' ' THR . . . . . 0.633 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 4.3 p -143.35 134.34 25.55 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 30' ' ' TRP . . . . . 0.652 ' O ' ' HA ' ' W' ' 19' ' ' TYR . 80.6 m95 -69.76 -64.69 0.83 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 120.271 -0.572 . . . . 0.0 110.577 177.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -105.37 -164.4 1.03 Allowed 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.581 -0.447 . . . . 0.0 111.099 179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 32' ' ' LYS . . . . . 0.887 ' HD3' ' HA ' ' W' ' 37' ' ' LYS . 56.6 mttp -52.91 132.61 48.74 Favored Pre-proline 0 N--CA 1.463 0.212 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -170.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 33' ' ' PRO . . . . . 0.507 ' HG2' HD23 ' W' ' 36' ' ' LEU . 35.8 Cg_exo -65.33 -159.78 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.497 3.464 . . . . 0.0 113.916 177.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 34' ' ' GLN . . . . . 0.545 ' HB2' HG21 ' W' ' 5' ' ' VAL . 49.9 mt-30 -78.69 -68.04 0.69 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.178 -173.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 35' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -85.0 -8.55 58.68 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.176 0.512 . . . . 0.0 110.865 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' W' W ' 36' ' ' LEU . . . . . 0.507 HD23 ' HG2' ' W' ' 33' ' ' PRO . 38.0 tp -98.79 98.71 9.79 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.871 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' W' W ' 37' ' ' LYS . . . . . 0.887 ' HA ' ' HD3' ' W' ' 32' ' ' LYS . 62.6 pttt . . . . . 0 C--O 1.246 0.88 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.202 -179.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 101' ' ' PRO . . . . . 0.417 ' HA ' ' HD3' ' P' ' 102' ' ' PRO . 2.5 Cg_endo . . . . . 0 N--CA 1.476 0.485 0 N-CA-C 110.092 -0.772 . . . . 0.0 110.092 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 102' ' ' PRO . . . . . 0.459 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 5.8 Cg_exo -78.27 149.14 24.61 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.63 2.22 . . . . 0.0 112.382 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 103' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 5.7 Cg_exo -78.0 148.87 25.21 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.244 2.629 . . . . 0.0 111.277 174.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 86.3 mt -78.09 149.09 33.95 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.016 176.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 105' ' ' ILE . . . . . 0.651 HG21 ' CD1' ' W' ' 30' ' ' TRP . 1.5 mp -78.52 148.55 73.68 Favored Pre-proline 0 C--N 1.326 -0.431 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 174.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.637 ' O ' HG22 ' P' ' 105' ' ' ILE . 72.0 Cg_endo -77.78 148.59 25.61 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.927 1.752 . . . . 0.0 110.078 164.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 107' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' P' ' 108' ' ' PRO . 72.7 Cg_endo -78.25 148.9 24.49 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.644 1.563 . . . . 0.0 112.468 178.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 108' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' P' ' 107' ' ' PRO . 5.2 Cg_exo -77.76 148.76 25.85 Favored 'Trans proline' 0 N--CA 1.459 -0.519 0 C-N-CA 122.894 2.396 . . . . 0.0 111.342 176.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' P' P ' 109' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo . . . . . 0 C--O 1.251 1.139 0 C-N-CA 122.609 2.206 . . . . 0.0 111.753 -179.745 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' W' W ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.664 0 N-CA-C 111.905 -0.478 . . . . 0.0 111.905 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' W' W ' 2' ' ' ALA . . . . . . . . . . . . . . . -87.26 -39.39 15.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.085 0.469 . . . . 0.0 111.059 179.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 3' ' ' THR . . . . . . . . . . . . . 7.0 t -89.23 123.01 33.06 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 121.237 0.542 . . . . 0.0 109.736 177.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 4' ' ' ALA . . . . . . . . . . . . . . . -141.23 100.14 3.73 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.505 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 5' ' ' VAL . . . . . 0.415 ' HB ' ' OE2' ' W' ' 35' ' ' GLU . 9.3 m -82.08 74.69 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 121.44 0.638 . . . . 0.0 109.912 176.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 6' ' ' SER . . . . . 0.461 ' HA ' ' NE1' ' W' ' 8' ' ' TRP . 9.3 t -171.93 -152.92 0.08 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.883 -177.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 7' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 68.6 83.91 0.16 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.422 1.106 . . . . 0.0 109.314 -169.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 8' ' ' TRP . . . . . 0.726 ' HZ3' ' HB2' ' W' ' 22' ' ' ASN . 49.0 m95 -124.94 114.87 19.73 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.729 -1.578 . . . . 0.0 108.662 -175.334 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 9' ' ' THR . . . . . 0.625 HG23 ' HB3' ' W' ' 21' ' ' TYR . 0.0 OUTLIER -99.93 173.58 6.6 Favored 'General case' 0 CA--C 1.508 -0.655 0 CA-C-O 121.94 0.876 . . . . 0.0 112.056 -179.573 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' W' W ' 10' ' ' GLU . . . . . 0.454 ' N ' ' OG1' ' W' ' 9' ' ' THR . 37.9 mt-10 -106.84 117.04 33.0 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 113.786 -1.552 . . . . 0.0 110.111 -176.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 11' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -127.02 106.69 9.45 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.686 -179.14 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 12' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -90.15 113.4 25.16 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.921 175.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 13' ' ' THR . . . . . . . . . . . . . 20.9 p -75.37 161.47 29.23 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.29 -19.8 64.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.815 0.34 . . . . 0.0 110.968 179.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -65.67 -37.99 88.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.003 176.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 16' ' ' GLY . . . . . . . . . . . . . . . 113.17 36.68 1.45 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.806 179.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 17' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -119.48 135.31 54.82 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 18' ' ' THR . . . . . . . . . . . . . 37.4 m -86.9 101.67 13.62 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 174.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 19' ' ' TYR . . . . . 0.77 ' HB2' ' HA ' ' W' ' 30' ' ' TRP . 0.1 OUTLIER -118.15 162.41 18.27 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 120.295 -0.562 . . . . 0.0 110.615 178.279 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' W' W ' 20' ' ' TYR . . . . . 0.801 ' HB2' ' OG1' ' W' ' 29' ' ' THR . 54.1 m-85 -107.71 150.62 26.72 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.209 -175.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 21' ' ' TYR . . . . . 0.625 ' HB3' HG23 ' W' ' 9' ' ' THR . 48.3 t80 -117.31 96.38 5.39 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 122.074 0.94 . . . . 0.0 108.49 -178.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 22' ' ' ASN . . . . . 0.756 ' OD1' ' HB2' ' W' ' 24' ' ' ARG . 2.0 t30 -55.01 120.2 6.56 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 113.027 -1.897 . . . . 0.0 111.198 -178.241 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 23' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -89.45 -12.79 39.16 Favored 'General case' 0 C--N 1.317 -0.837 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 174.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 24' ' ' ARG . . . . . 0.756 ' HB2' ' OD1' ' W' ' 22' ' ' ASN . 33.3 mtp180 -45.92 -80.1 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 112.697 0.628 . . . . 0.0 112.697 -175.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 25' ' ' THR . . . . . 0.67 ' H ' HD21 ' W' ' 22' ' ' ASN . 14.9 t -110.98 25.16 12.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.118 175.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 26' ' ' LEU . . . . . 0.406 ' HA ' HD22 ' W' ' 26' ' ' LEU . 0.6 OUTLIER 63.8 86.69 0.12 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.171 -173.881 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' W' W ' 27' ' ' GLU . . . . . 0.617 ' N ' HD22 ' W' ' 22' ' ' ASN . 8.4 tp10 -142.26 165.1 28.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.46 -174.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 28' ' ' SER . . . . . 0.604 ' HB2' ' CD ' ' P' ' 106' ' ' PRO . 4.3 m -114.53 152.46 31.7 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.622 171.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 29' ' ' THR . . . . . 0.801 ' OG1' ' HB2' ' W' ' 20' ' ' TYR . 45.7 p -143.9 135.11 25.67 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 30' ' ' TRP . . . . . 0.812 ' CH2' HD13 ' P' ' 105' ' ' ILE . 77.7 m95 -69.81 -65.86 0.66 Allowed 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 118.293 0.497 . . . . 0.0 110.821 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 31' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -105.33 -175.52 2.82 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.557 -0.457 . . . . 0.0 111.959 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 32' ' ' LYS . . . . . 0.419 ' HG3' ' HB3' ' W' ' 36' ' ' LEU . 38.5 ttmt -62.74 128.9 92.48 Favored Pre-proline 0 CA--C 1.533 0.3 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.636 -174.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 33' ' ' PRO . . . . . 0.624 ' HD2' HD12 ' W' ' 36' ' ' LEU . 50.2 Cg_exo -64.82 153.85 75.83 Favored 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.706 2.937 . . . . 0.0 112.509 171.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 34' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -63.83 -30.94 71.98 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.264 -179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' W' W ' 35' ' ' GLU . . . . . 0.449 ' H ' ' HG2' ' W' ' 35' ' ' GLU . 5.6 pt-20 -85.8 6.95 25.75 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.425 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' W' W ' 36' ' ' LEU . . . . . 0.666 ' HG ' ' CD1' ' W' ' 8' ' ' TRP . 1.0 OUTLIER -103.68 110.96 23.24 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.803 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' W' W ' 37' ' ' LYS . . . . . 0.494 ' H ' ' HG3' ' W' ' 37' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 119.153 -0.451 . . . . 0.0 111.281 -179.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 101' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo . . . . . 0 N--CA 1.479 0.664 0 N-CA-C 110.535 -0.602 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' P' P ' 102' ' ' PRO . . . . . 0.463 ' HA ' ' HD3' ' P' ' 103' ' ' PRO . 6.0 Cg_exo -78.31 149.07 24.43 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.964 2.443 . . . . 0.0 111.249 173.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 103' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' P' ' 102' ' ' PRO . 3.0 Cg_exo -77.87 148.83 25.57 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.21 1.94 . . . . 0.0 111.57 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 104' ' ' LEU . . . . . . . . . . . . . 56.1 tp -78.08 148.77 34.09 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 105' ' ' ILE . . . . . 0.826 HD12 ' H ' ' P' ' 105' ' ' ILE . 1.1 mp -78.31 148.95 75.08 Favored Pre-proline 0 C--N 1.327 -0.401 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.515 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 106' ' ' PRO . . . . . 0.604 ' CD ' ' HB2' ' W' ' 28' ' ' SER . 73.0 Cg_endo -78.18 148.86 24.65 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.195 2.597 . . . . 0.0 109.663 160.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 107' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' P' ' 106' ' ' PRO . 3.2 Cg_exo -77.98 148.76 25.17 Favored 'Trans proline' 0 N--CA 1.457 -0.661 0 C-N-CA 121.021 1.148 . . . . 0.0 111.535 177.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 108' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -78.02 148.97 25.25 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.461 2.107 . . . . 0.0 112.717 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' P' P ' 109' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo . . . . . 0 C--O 1.244 0.812 0 C-N-CA 122.438 2.092 . . . . 0.0 111.978 176.451 . . . . . . . . 0 0 . 1 stop_ save_