data_5mfy_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 5mfy _Structure_validation_residue.Date_analyzed 2016-12-02 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.612 HG11 ' HE1' ' A' ' 51' ' ' TRP . 16.8 m -67.18 118.34 54.96 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.144 0.497 . . . . 0.0 110.805 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -71.51 131.62 19.13 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.262 1.974 . . . . 0.0 112.035 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.445 ' OD2' HG21 ' A' ' 14' ' ' THR . 9.1 p-10 -105.51 120.8 42.54 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.5 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 29.0 p -71.09 7.11 1.32 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.69 -176.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.414 ' H ' ' C ' ' A' ' 11' ' ' ASP . 13.1 m -86.25 -12.46 49.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 175.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.445 HG21 ' OD2' ' A' ' 11' ' ' ASP . 40.0 p -99.77 11.22 39.81 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.162 0.506 . . . . 0.0 110.521 173.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.5 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -92.95 169.34 10.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.843 -177.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -119.51 103.94 9.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 92.5 t80 -65.54 117.56 8.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.096 0.474 . . . . 0.0 110.638 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -93.73 105.9 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -71.6 -26.83 62.75 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.008 0.432 . . . . 0.0 111.123 -173.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -73.73 -28.3 61.64 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.854 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.1 t -100.88 -31.18 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.924 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.36 11.58 60.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.193 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -123.13 157.53 32.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.747 0.308 . . . . 0.0 110.765 -177.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.611 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.0 m-85 -87.28 116.22 25.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -74.36 128.1 34.7 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.288 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.456 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 8.9 t70 -102.51 98.9 11.72 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.696 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -13.44 24.69 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.805 2.337 . . . . 0.0 112.413 172.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -47.28 70.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.058 0.456 . . . . 0.0 110.649 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.7 m -114.38 -41.09 3.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.49 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.9 38.67 0.87 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -178.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.7 mt -123.83 176.59 6.2 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.113 0.482 . . . . 0.0 110.911 -175.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -115.16 125.31 53.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.365 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.611 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 84.3 t80 -93.52 121.15 34.63 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.288 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.76 112.64 41.69 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.583 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.8 Cg_endo -63.06 -23.56 73.66 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.731 2.287 . . . . 0.0 113.341 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -87.18 -49.49 7.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 -174.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.2 m -86.77 -20.59 27.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.119 -177.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 66.38 32.43 7.61 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.426 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -119.54 162.21 19.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.383 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -95.76 140.26 30.82 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.349 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -114.5 120.15 39.28 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.006 -176.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.427 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 48.2 t-20 -83.21 112.87 20.24 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.9 t -74.54 -13.55 60.69 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -173.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.9 tp -89.76 -46.45 8.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -99.19 -5.78 29.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.24 0.543 . . . . 0.0 110.976 -176.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 61.67 30.38 18.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.195 176.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.442 ' NE2' HD22 ' A' ' 49' ' ' LEU . 21.1 pt20 -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.795 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -113.68 140.72 48.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.831 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.537 HD23 ' HA ' ' A' ' 60' ' ' PRO . 19.5 mt -136.11 165.06 26.58 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.478 -173.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 39.3 p90 -140.98 156.84 45.98 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 174.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.612 ' HE1' HG11 ' A' ' 9' ' ' VAL . 72.0 t-105 -88.99 125.6 35.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.878 0.37 . . . . 0.0 111.013 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -103.99 124.41 48.96 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.33 -20.63 79.37 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.314 -173.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -85.98 -50.93 6.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.821 0.311 . . . . 0.0 110.74 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.12 -18.65 60.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.262 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 56.86 48.7 15.5 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.407 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -156.32 169.57 24.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.497 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.83 118.62 36.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.857 178.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.67 HG13 ' HD2' ' A' ' 60' ' ' PRO . 0.9 OUTLIER -107.09 144.95 30.16 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -177.748 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.67 ' HD2' HG13 ' A' ' 59' ' ' VAL . 39.8 Cg_exo -55.16 122.4 11.63 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.631 2.221 . . . . 0.0 112.119 178.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.047 -177.038 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 110.531 -0.174 . . . . 0.0 110.531 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.662 HG12 ' HE1' ' A' ' 51' ' ' TRP . 10.0 m -64.93 115.64 22.69 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.181 0.515 . . . . 0.0 110.581 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.25 132.54 34.26 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.411 2.74 . . . . 0.0 114.056 -172.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -100.65 119.46 38.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.049 174.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 25.3 p -69.66 -10.95 60.32 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.923 0.392 . . . . 0.0 111.778 -175.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 t -69.46 -18.49 63.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.926 175.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.1 p -95.98 9.31 41.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.911 0.386 . . . . 0.0 110.882 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.44 ' HH ' ' HE2' ' A' ' 40' ' ' TYR . 9.0 m-30 -91.34 164.5 13.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.191 0.519 . . . . 0.0 111.199 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -117.57 104.66 11.27 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.647 176.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 60.8 t80 -62.58 113.38 2.94 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.563 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -87.93 96.26 10.42 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.61 -18.28 64.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.087 0.47 . . . . 0.0 111.318 -175.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.8 t -86.51 -15.03 41.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.368 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -108.98 -30.57 8.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.136 0.493 . . . . 0.0 110.452 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.63 11.15 58.39 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.352 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.39 158.22 43.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.821 0.343 . . . . 0.0 110.61 -177.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 63.8 m-85 -79.31 117.76 20.6 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.938 174.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.528 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 61.8 t80 -76.8 122.04 24.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.819 0.342 . . . . 0.0 110.533 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.536 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -83.62 103.06 2.34 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.414 173.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.528 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 5.9 Cg_exo -78.51 -15.21 14.03 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.632 2.221 . . . . 0.0 110.972 -178.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 p -75.26 -49.26 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.704 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 m -105.83 -28.52 10.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.988 0.423 . . . . 0.0 111.914 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.42 41.25 3.47 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.677 -176.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.536 ' H ' ' HB2' ' A' ' 26' ' ' ASP . 81.9 mt -125.12 -170.89 2.25 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -175.193 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -136.82 124.79 22.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.223 174.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -90.74 121.79 32.93 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -87.22 115.46 62.76 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.834 175.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -60.94 -24.67 79.93 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 122.616 2.211 . . . . 0.0 112.788 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -84.2 -53.22 5.66 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.06 -175.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.479 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 19.2 m -80.15 -23.0 41.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.889 0.376 . . . . 0.0 111.487 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 65.97 25.73 10.99 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.659 -175.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.479 ' HD2' ' HB3' ' A' ' 37' ' ' SER . 60.1 m-85 -114.17 167.63 10.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.142 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.44 ' HE2' ' HH ' ' A' ' 15' ' ' TYR . 93.5 m-85 -101.27 144.99 29.44 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.526 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -116.91 113.72 22.84 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.045 -178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.46 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 53.9 t-20 -75.54 104.03 5.92 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -19.61 60.97 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.892 0.377 . . . . 0.0 110.903 -174.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.6 tp -79.84 -41.7 25.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.964 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -101.72 -12.2 18.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.365 0.602 . . . . 0.0 111.113 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 62.93 63.65 0.93 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.995 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.46 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 19.6 pt20 -148.15 168.34 22.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.224 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.417 ' HA ' ' O ' ' A' ' 40' ' ' TYR . 26.8 m-85 -113.65 143.33 44.76 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.378 0.609 . . . . 0.0 111.581 -178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.543 HD23 ' HA ' ' A' ' 60' ' ' PRO . 30.2 mt -140.02 169.31 17.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.591 -172.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -142.02 144.86 33.85 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 171.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.662 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.1 t-105 -77.42 113.34 15.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.202 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.455 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 14.1 t70 -97.28 117.55 31.76 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.41 -24.88 75.93 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.163 -0.541 . . . . 0.0 112.853 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.455 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 29.9 tt0 -71.33 -47.72 54.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.334 0.588 . . . . 0.0 110.547 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 mttp -87.06 -14.95 40.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.702 -176.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 59.41 41.84 18.87 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.535 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.574 HG23 HG12 ' A' ' 59' ' ' VAL . 13.0 t -150.96 155.59 39.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.526 -177.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -87.27 105.25 17.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.574 HG12 HG23 ' A' ' 57' ' ' THR . 1.1 m -100.46 148.18 34.6 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.628 -176.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.543 ' HA ' HD23 ' A' ' 49' ' ' LEU . 31.8 Cg_exo -58.87 128.72 29.01 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.096 2.531 . . . . 0.0 112.867 -177.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.433 176.663 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.484 HG12 ' HE1' ' A' ' 51' ' ' TRP . 16.9 m -60.09 119.73 44.52 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.291 0.567 . . . . 0.0 110.827 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.582 ' HG2' ' HH ' ' A' ' 40' ' ' TYR . 73.9 Cg_endo -81.24 132.77 8.37 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.714 2.276 . . . . 0.0 112.673 -177.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.409 ' OD2' ' HB2' ' A' ' 13' ' ' SER . 23.0 t70 -96.95 127.23 42.72 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.179 178.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.0 p -87.02 -7.69 57.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -174.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.409 ' HB2' ' OD2' ' A' ' 11' ' ' ASP . 27.9 m -71.01 -39.41 72.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.167 0.508 . . . . 0.0 109.878 178.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 t -84.35 8.28 16.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.202 -178.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.558 ' HE2' ' HE1' ' A' ' 40' ' ' TYR . 7.5 m-30 -80.02 161.58 25.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.226 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -104.65 104.15 13.92 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.621 -175.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -60.94 112.95 2.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.312 0.577 . . . . 0.0 111.324 -175.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -82.89 96.78 8.37 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -22.52 59.75 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.18 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.4 m -81.1 -19.39 43.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.089 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.8 t -109.92 -30.39 7.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.061 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.19 37.22 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.58 ' HB2' ' HD1' ' A' ' 32' ' ' TYR . 95.1 m-85 -136.14 161.43 35.76 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.578 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.4 m-85 -81.2 116.33 21.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 175.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -74.7 129.47 37.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.032 0.444 . . . . 0.0 110.263 177.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.9 t70 -102.83 99.36 13.48 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.206 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 56.8 Cg_endo -72.68 -11.82 26.3 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.078 2.519 . . . . 0.0 112.446 175.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.96 -58.18 3.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.9 m -101.1 -39.86 7.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.062 0.458 . . . . 0.0 110.349 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 114.34 40.96 0.91 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 80.6 mt -124.06 173.5 8.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.994 0.426 . . . . 0.0 111.4 -175.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.58 ' HD1' ' HB2' ' A' ' 23' ' ' TYR . 20.1 m-85 -112.69 125.31 54.16 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.227 174.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.578 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 85.4 t80 -96.71 120.11 36.42 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.54 ' HA ' ' HD2' ' A' ' 23' ' ' TYR . 21.8 t0 -84.1 114.28 53.37 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 175.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -61.76 -23.39 76.13 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.408 HD22 ' HA ' ' A' ' 36' ' ' ASN . 3.3 t-20 -83.9 -53.27 5.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.944 0.402 . . . . 0.0 111.156 -176.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -82.62 -21.3 35.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.214 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 65.45 30.33 10.88 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.882 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.401 ' HD2' ' HB3' ' A' ' 50' ' ' TYR . 30.9 m-85 -116.23 158.78 22.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.275 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.582 ' HH ' ' HG2' ' A' ' 10' ' ' PRO . 90.1 m-85 -96.09 137.65 34.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.305 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -110.53 115.83 30.3 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.047 -178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -78.51 110.52 13.68 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -72.25 -26.64 62.08 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.823 0.344 . . . . 0.0 111.041 -175.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.1 tp -80.63 -44.2 19.26 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.892 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.3 m -98.6 -7.36 28.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.418 0.628 . . . . 0.0 111.215 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 59.56 43.44 15.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.522 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -124.95 162.51 24.31 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.621 -176.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -107.19 139.36 41.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.223 0.535 . . . . 0.0 110.908 178.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.638 HD22 ' HA ' ' A' ' 60' ' ' PRO . 27.0 mt -137.52 166.3 24.22 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.825 -174.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.694 ' HD1' ' HB3' ' A' ' 61' ' ' ALA . 43.2 p90 -146.85 146.92 30.37 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.484 ' HE1' HG12 ' A' ' 9' ' ' VAL . 59.5 t-105 -80.26 116.48 20.37 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.372 -179.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.5 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 12.5 t70 -100.56 113.13 25.7 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 172.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.77 -23.62 69.23 Favored Glycine 0 N--CA 1.453 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.543 -173.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -75.73 -48.32 22.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.036 0.446 . . . . 0.0 110.078 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.5 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 26.1 mmmt -79.26 -18.22 53.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.059 -176.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 61.9 38.64 14.36 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.441 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.465 HG23 HG12 ' A' ' 59' ' ' VAL . 7.4 t -149.76 162.36 40.41 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.528 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -92.62 108.78 20.24 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.465 HG12 HG23 ' A' ' 57' ' ' THR . 3.7 m -103.26 140.0 20.65 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.837 -173.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.638 ' HA ' HD22 ' A' ' 49' ' ' LEU . 52.9 Cg_exo -56.27 122.97 12.73 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.338 2.692 . . . . 0.0 112.778 -176.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.694 ' HB3' ' HD1' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.577 -177.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.8 m -54.84 119.16 20.08 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.372 0.606 . . . . 0.0 109.983 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.46 132.55 12.39 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.678 2.252 . . . . 0.0 113.402 -170.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -81.29 133.06 35.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.279 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.429 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 12.6 p -94.65 -14.99 24.36 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.072 0.463 . . . . 0.0 110.741 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -76.0 -17.9 59.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.666 177.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.7 p -89.72 0.77 56.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.429 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 21.4 m-30 -85.18 158.87 20.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.551 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -100.86 103.56 14.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.745 -0.662 . . . . 0.0 109.477 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -66.82 116.68 7.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.809 0.338 . . . . 0.0 110.576 -177.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -96.01 113.44 25.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.9 -16.99 56.29 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.209 0.528 . . . . 0.0 111.522 -175.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.4 t -88.37 -19.29 26.82 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.893 -179.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.5 t -105.29 -30.5 9.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.305 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.02 22.71 44.2 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.3 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -139.23 156.05 47.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.017 0.437 . . . . 0.0 111.082 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.433 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 62.7 m-85 -82.07 110.85 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.918 171.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -74.66 126.84 31.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.66 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -97.95 102.21 12.98 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.07 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.57 -16.97 48.15 Favored 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 123.141 2.561 . . . . 0.0 112.801 175.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 m -69.61 -65.79 0.67 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.874 0.369 . . . . 0.0 110.809 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -33.72 15.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.413 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.88 41.53 1.96 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.291 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.512 HD23 ' HA ' ' A' ' 42' ' ' ASN . 95.7 mt -121.88 176.19 5.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.302 . . . . 0.0 110.631 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -123.9 125.77 45.21 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.084 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.433 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 87.6 t80 -96.2 125.68 40.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.534 0.207 . . . . 0.0 110.448 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -89.3 117.36 68.13 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 175.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -66.99 -19.72 51.61 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.531 2.154 . . . . 0.0 112.726 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -86.57 -51.18 6.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.81 0.338 . . . . 0.0 111.148 -176.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.4 m -82.55 -19.77 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.193 0.521 . . . . 0.0 110.891 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 63.34 30.72 15.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.956 -177.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -119.55 163.86 16.69 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.999 177.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -97.42 153.12 18.31 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.433 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -124.22 121.86 36.22 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.785 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.512 ' HA ' HD23 ' A' ' 31' ' ' LEU . 45.0 t-20 -78.68 116.41 19.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 m -66.21 -25.45 66.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.822 -172.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.5 -50.49 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.828 0.347 . . . . 0.0 111.416 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.1 m -87.08 -13.94 42.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.556 0.693 . . . . 0.0 110.896 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 60.69 39.51 17.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.106 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -113.67 168.29 9.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.162 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -105.67 140.53 38.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.457 0.646 . . . . 0.0 111.233 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.682 HD22 ' HA ' ' A' ' 60' ' ' PRO . 11.9 mt -134.94 171.22 14.71 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.312 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.446 ' CE1' HG21 ' A' ' 59' ' ' VAL . 32.6 p90 -148.01 153.79 39.42 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 173.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 59.5 t-105 -83.7 122.37 28.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.911 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -106.86 124.17 49.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 172.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -73.94 -15.01 79.82 Favored Glycine 0 N--CA 1.454 -0.157 0 C-N-CA 121.02 -0.609 . . . . 0.0 113.168 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -87.54 -47.98 8.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.703 0.287 . . . . 0.0 110.527 -177.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -81.4 -15.17 56.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.059 0.457 . . . . 0.0 110.825 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.66 41.45 15.16 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.376 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.8 t -158.6 169.39 24.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.861 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -91.92 112.27 24.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.446 HG21 ' CE1' ' A' ' 50' ' ' TYR . 2.5 m -106.56 146.84 33.84 Favored Pre-proline 0 C--N 1.318 -0.774 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.328 -176.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.682 ' HA ' HD22 ' A' ' 49' ' ' LEU . 38.8 Cg_exo -57.25 122.76 12.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.968 2.445 . . . . 0.0 113.023 -175.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.882 177.525 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 32.5 m -60.33 133.75 90.87 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.46 . . . . 0.0 110.929 178.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -85.58 152.99 10.34 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.017 2.478 . . . . 0.0 112.904 -178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.666 ' O ' ' HB ' ' A' ' 14' ' ' THR . 12.7 t70 -121.9 127.06 50.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.485 176.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.451 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 67.7 p -86.85 5.7 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -170.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.1 t -87.17 -23.42 24.82 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 172.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.666 ' HB ' ' O ' ' A' ' 11' ' ' ASP . 1.8 m -75.3 -17.95 60.16 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.948 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -78.07 164.06 25.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.338 -177.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -112.21 102.81 10.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.63 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.512 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . 89.6 t80 -72.57 128.19 34.83 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.838 0.351 . . . . 0.0 111.697 -174.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -108.55 130.36 55.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.172 172.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.0 -24.09 30.7 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.218 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -24.73 56.48 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.37 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.6 t -111.8 -30.27 7.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.408 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.12 23.96 46.45 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.541 -0.838 . . . . 0.0 111.934 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -125.75 155.5 40.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.896 0.379 . . . . 0.0 110.441 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.617 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 70.6 m-85 -88.24 114.06 24.48 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.428 169.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -73.84 132.97 43.1 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.932 0.396 . . . . 0.0 110.369 -177.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -104.1 97.78 12.28 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.606 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.26 -12.89 28.03 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.875 2.384 . . . . 0.0 112.057 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -51.9 65.0 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.768 -178.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.6 m -117.19 -41.14 3.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.933 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.21 38.57 0.55 Allowed Glycine 0 CA--C 1.509 -0.34 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -115.01 175.68 5.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.139 0.495 . . . . 0.0 111.11 -174.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -123.33 125.22 44.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.799 171.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.598 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.8 t80 -93.06 122.94 35.94 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.602 0.239 . . . . 0.0 110.434 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -85.17 111.35 35.55 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.617 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 16.3 Cg_endo -63.98 -25.87 66.6 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.421 2.081 . . . . 0.0 113.549 -176.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -89.29 -43.75 10.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 0.0 111.294 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.1 m -88.22 -18.08 29.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -177.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 63.08 25.54 15.0 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.89 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -107.85 167.6 9.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 174.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.79 139.57 39.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.274 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -109.11 114.39 28.07 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.573 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.462 ' HB2' HD12 ' A' ' 49' ' ' LEU . 47.0 t-20 -73.57 113.45 10.7 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.39 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.9 t -73.06 -17.34 61.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.427 . . . . 0.0 110.971 -176.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 tp -87.94 -51.38 5.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.995 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -94.68 -14.32 24.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.364 -174.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 63.12 46.98 4.36 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.141 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -129.79 163.9 25.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.927 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -99.3 139.19 35.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.581 . . . . 0.0 111.131 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.539 HD23 ' HA ' ' A' ' 60' ' ' PRO . 15.3 mt -137.46 168.09 20.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.741 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -144.27 149.94 37.11 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -79.34 117.77 20.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.734 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.53 ' OD2' ' HG3' ' A' ' 55' ' ' LYS . 16.3 t70 -103.12 124.7 49.06 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 172.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.36 -12.02 84.72 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -80.63 -52.1 7.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.013 0.435 . . . . 0.0 109.894 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.53 ' HG3' ' OD2' ' A' ' 52' ' ' ASP . 66.1 mttm -77.33 -18.57 57.35 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.3 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 62.05 43.73 8.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.401 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -158.29 170.91 21.19 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -96.7 112.76 24.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.67 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.7 m -109.42 152.9 42.96 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.829 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.539 ' HA ' HD23 ' A' ' 49' ' ' LEU . 11.9 Cg_endo -55.72 128.58 30.94 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.219 2.613 . . . . 0.0 112.663 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.416 -177.277 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.478 HG12 ' HE1' ' A' ' 51' ' ' TRP . 29.6 m -60.66 131.59 91.07 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.18 0.514 . . . . 0.0 111.077 -178.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -89.37 132.53 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.958 2.439 . . . . 0.0 112.951 -178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -91.96 128.07 37.66 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.466 175.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.557 ' HA ' ' CD2' ' A' ' 15' ' ' TYR . 42.8 p -84.24 -11.58 56.22 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.089 0.471 . . . . 0.0 111.432 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -73.46 -13.99 61.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.902 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.5 p -103.11 18.07 22.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.06 0.457 . . . . 0.0 111.093 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.557 ' CD2' ' HA ' ' A' ' 12' ' ' THR . 19.6 m-30 -98.72 171.72 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.657 178.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -109.34 103.49 12.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.037 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.01 118.67 6.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.169 0.509 . . . . 0.0 110.724 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -94.91 110.02 21.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.387 -0.824 . . . . 0.0 108.986 178.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.21 -23.75 60.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.443 -174.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.7 t -77.13 -28.16 54.18 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.181 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 m -102.06 -30.76 10.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.07 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.82 6.05 76.8 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.509 -178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.423 ' CE2' ' HB2' ' A' ' 34' ' ' ASP . 10.0 m-85 -114.25 161.38 17.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.307 -0.446 . . . . 0.0 110.19 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -89.44 115.67 27.05 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.599 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 81.6 t80 -74.78 121.86 22.42 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.763 -177.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.444 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.8 OUTLIER -80.02 103.44 1.72 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.975 174.333 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 2.0 Cg_endo -80.85 -19.95 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.453 2.102 . . . . 0.0 110.67 177.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -85.08 -31.65 23.25 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.598 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.6 -18.62 13.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.264 -173.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.91 30.81 58.84 Favored Glycine 0 N--CA 1.454 -0.143 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.826 HD22 ' HA ' ' A' ' 42' ' ' ASN . 71.0 mt -125.46 -175.83 3.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.367 . . . . 0.0 110.559 -173.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.556 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 53.3 m-85 -125.62 125.1 42.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.74 171.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -91.38 121.62 33.27 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.423 ' HB2' ' CE2' ' A' ' 23' ' ' TYR . 33.9 t0 -83.17 117.8 69.72 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 175.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -67.66 -18.23 48.13 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.159 1.906 . . . . 0.0 112.414 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -86.93 -53.24 5.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.938 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.643 ' HB2' ' HD1' ' A' ' 39' ' ' TYR . 68.0 p -89.08 -21.5 23.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.856 0.36 . . . . 0.0 111.525 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 68.11 23.96 7.86 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.52 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.643 ' HD1' ' HB2' ' A' ' 37' ' ' SER . 74.8 m-85 -102.32 159.32 15.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.575 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.66 139.55 33.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.12 0.486 . . . . 0.0 110.569 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.556 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 64.4 t80 -110.37 116.49 31.53 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.038 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.826 ' HA ' HD22 ' A' ' 31' ' ' LEU . 45.7 t-20 -74.85 108.44 7.59 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 m -64.1 -27.03 68.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.874 0.369 . . . . 0.0 111.511 -174.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.8 tp -78.15 -50.97 10.96 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.486 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.6 m -95.7 -8.63 34.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.343 0.592 . . . . 0.0 111.229 -172.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 61.66 40.06 13.69 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.931 0.872 . . . . 0.0 109.469 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -111.31 165.85 11.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.218 -172.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -119.41 138.92 52.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.456 0.646 . . . . 0.0 111.34 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.658 HD23 ' HA ' ' A' ' 60' ' ' PRO . 20.0 mt -135.81 174.47 10.58 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.645 -176.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.56 ' HD2' ' HB2' ' A' ' 61' ' ' ALA . 46.6 p90 -149.96 146.85 27.27 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.478 ' HE1' HG12 ' A' ' 9' ' ' VAL . 65.1 t-105 -79.7 112.94 17.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.835 0.35 . . . . 0.0 110.204 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.409 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 9.7 t70 -91.63 114.85 27.5 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.71 -14.19 82.77 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.85 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.409 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 26.6 tt0 -79.21 -48.15 14.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.397 0.618 . . . . 0.0 109.774 178.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.8 mttp -87.94 -19.08 27.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.773 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 59.47 61.92 1.89 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.593 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -164.73 164.67 21.2 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.177 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -96.86 108.04 20.65 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.272 0.558 . . . . 0.0 109.584 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -106.53 146.23 32.62 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.267 -176.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.658 ' HA ' HD23 ' A' ' 49' ' ' LEU . 41.8 Cg_endo -66.08 127.57 17.9 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.958 2.438 . . . . 0.0 112.551 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.56 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.052 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.7 m -51.47 123.8 23.23 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.621 0.724 . . . . 0.0 111.716 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.599 ' HG2' ' HH ' ' A' ' 40' ' ' TYR . 74.2 Cg_endo -78.62 132.44 10.97 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.754 2.303 . . . . 0.0 112.664 -179.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -98.05 127.98 44.31 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 173.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.4 p -79.48 -7.17 58.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -177.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 m -81.08 -23.7 38.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.656 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 10.74 17.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.976 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.48 ' HH ' ' HB2' ' A' ' 10' ' ' PRO . 16.3 m-30 -93.7 162.48 13.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.849 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -107.49 112.32 25.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.581 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -69.56 125.9 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.944 0.402 . . . . 0.0 110.629 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -100.63 132.58 45.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.79 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -84.86 -33.41 22.85 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.585 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t -75.33 -28.79 59.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.261 0.553 . . . . 0.0 109.968 -174.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.3 m -107.0 -25.69 11.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.269 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.27 22.0 68.95 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.724 178.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -117.05 154.53 30.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.824 0.345 . . . . 0.0 110.555 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.778 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 73.3 m-85 -89.18 111.1 21.8 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.177 174.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -74.57 122.59 23.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.029 0.442 . . . . 0.0 111.004 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.429 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 5.6 t70 -94.52 111.4 53.76 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.273 175.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 2.0 Cg_endo -84.33 -11.73 8.26 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.446 2.764 . . . . 0.0 111.799 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.83 -52.59 14.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.856 -178.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 m -104.95 -38.74 6.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.267 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.38 38.28 1.51 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.423 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.1 mt -115.73 174.35 6.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 -174.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -123.13 125.83 45.88 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.819 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.778 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.3 t80 -90.41 127.16 36.12 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.908 0.385 . . . . 0.0 110.223 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -88.96 106.82 14.36 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.464 178.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.563 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 24.9 Cg_endo -66.83 -21.34 50.93 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.655 2.237 . . . . 0.0 112.416 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -89.04 -43.68 10.92 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.613 -174.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.1 m -92.65 -16.47 25.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.274 -178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 63.18 36.44 12.02 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.712 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -131.64 169.64 15.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.465 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . 0.599 ' HH ' ' HG2' ' A' ' 10' ' ' PRO . 94.3 m-85 -97.6 149.84 21.8 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.893 0.377 . . . . 0.0 110.505 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -119.12 121.15 39.12 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.599 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.494 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 46.7 t-20 -82.08 108.87 15.91 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 p -73.62 -12.78 60.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.903 0.382 . . . . 0.0 111.723 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.6 tp -90.63 -45.56 8.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.818 0.342 . . . . 0.0 111.121 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 m -99.19 -12.96 19.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.498 . . . . 0.0 111.322 -175.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 63.48 63.58 0.87 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.786 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.494 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 4.5 pt20 -146.2 162.81 37.21 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.112 -176.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -103.5 137.48 41.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.275 0.559 . . . . 0.0 110.812 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.662 HD22 ' HA ' ' A' ' 60' ' ' PRO . 16.5 mt -133.55 165.46 24.83 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.837 -171.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.615 ' HD1' ' HB2' ' A' ' 61' ' ' ALA . 37.1 p90 -143.4 150.33 38.94 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -87.42 120.53 28.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.883 0.373 . . . . 0.0 110.534 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.462 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 13.0 t70 -102.02 124.02 46.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -66.42 -18.77 68.0 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 114.111 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -96.33 -41.49 8.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 117.316 0.558 . . . . 0.0 110.458 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.462 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 10.9 mmmm -73.7 -18.24 61.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -177.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 57.25 38.03 28.52 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.373 175.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.412 HG23 HG13 ' A' ' 59' ' ' VAL . 13.0 t -158.7 163.23 37.02 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.861 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -87.59 108.84 19.25 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.414 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -101.79 142.63 24.97 Favored Pre-proline 0 C--N 1.314 -0.973 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.265 -175.836 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.662 ' HA ' HD22 ' A' ' 49' ' ' LEU . 22.0 Cg_exo -65.07 122.49 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.863 2.376 . . . . 0.0 113.108 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.615 ' HB2' ' HD1' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.517 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.248 0 CA-C-O 120.364 0.126 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.469 HG12 ' HE1' ' A' ' 51' ' ' TRP . 15.6 m -59.7 119.74 43.21 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 111.357 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -85.0 139.37 7.25 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -101.39 124.42 47.04 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.514 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 35.1 p -75.45 -12.02 60.16 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.567 -176.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -72.16 -23.72 61.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.759 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -96.57 18.13 14.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.887 0.375 . . . . 0.0 111.804 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.514 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 16.3 m-30 -93.28 171.6 8.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.706 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -109.68 103.91 12.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.237 179.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.64 123.64 21.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.916 0.389 . . . . 0.0 110.141 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -104.54 137.5 42.31 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.287 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -83.64 -29.55 27.59 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.571 -174.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.9 m -84.99 -30.12 24.47 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.071 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.5 t -95.59 -24.92 16.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.07 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 74.53 8.49 80.87 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.992 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.446 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 58.5 m-85 -118.46 166.37 12.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.056 0.455 . . . . 0.0 110.558 -179.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.627 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 80.1 m-85 -89.53 113.12 24.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.472 172.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -74.28 129.78 38.46 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.026 0.441 . . . . 0.0 110.591 -177.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.3 t70 -100.84 99.7 10.97 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.234 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 60.2 Cg_endo -74.19 -11.63 23.12 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 123.106 2.537 . . . . 0.0 112.54 174.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.19 -46.99 66.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.928 0.394 . . . . 0.0 110.81 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 m -116.16 -41.88 3.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.668 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.28 36.83 0.68 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.555 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 96.8 mt -117.83 178.08 4.54 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.882 0.372 . . . . 0.0 110.844 -175.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -122.73 125.49 45.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.04 175.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.525 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 82.3 t80 -92.97 121.33 34.2 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.446 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 22.9 t0 -85.55 114.16 55.0 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.307 -0.406 . . . . 0.0 109.987 176.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.627 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.1 Cg_endo -62.05 -21.59 72.68 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.618 2.212 . . . . 0.0 112.634 178.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -84.93 -53.29 5.41 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.928 -176.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.451 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 19.1 m -83.18 -19.46 36.51 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 66.25 29.58 9.55 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.598 0.561 . . . . 0.0 110.696 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.451 ' HD1' ' HB3' ' A' ' 37' ' ' SER . 52.4 m-85 -120.95 163.83 17.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.721 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -98.15 141.5 31.0 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.238 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -115.57 116.18 27.71 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.83 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.471 ' O ' ' HA ' ' A' ' 46' ' ' GLN . 44.4 t-20 -74.43 119.08 18.14 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -75.95 -16.73 59.96 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.7 tp -92.78 -57.71 2.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.982 0.42 . . . . 0.0 111.093 -179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 m -87.17 -14.17 41.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.637 0.732 . . . . 0.0 110.885 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.471 ' HA ' ' O ' ' A' ' 42' ' ' ASN . 77.1 mt-30 60.02 47.84 9.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.576 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -119.32 169.36 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.627 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -109.7 138.25 46.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.502 0.668 . . . . 0.0 111.351 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.63 HD22 ' HA ' ' A' ' 60' ' ' PRO . 18.2 mt -134.99 169.55 17.24 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.319 -173.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.446 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 34.2 p90 -150.06 149.92 31.0 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . 0.469 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.0 t-105 -83.59 119.05 24.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.81 0.338 . . . . 0.0 110.347 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -104.23 133.91 48.35 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.949 174.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.79 -11.61 85.26 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.341 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -90.12 -49.42 6.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.168 0.508 . . . . 0.0 110.043 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -80.77 -18.09 48.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.568 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 46.38 61.99 2.5 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.438 0.637 . . . . 0.0 111.448 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.473 HG21 HG11 ' A' ' 59' ' ' VAL . 14.7 t -169.95 170.19 7.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.149 -0.932 . . . . 0.0 108.713 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -89.56 99.74 12.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.473 HG11 HG21 ' A' ' 57' ' ' THR . 3.3 m -95.7 145.55 29.75 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.458 -176.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.63 ' HA ' HD22 ' A' ' 49' ' ' LEU . 27.6 Cg_endo -62.27 122.93 11.57 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.659 2.239 . . . . 0.0 112.321 -177.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.135 179.35 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.61 0.243 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 29.9 m -63.62 137.62 97.14 Favored Pre-proline 0 C--O 1.236 0.368 0 CA-C-O 121.154 0.502 . . . . 0.0 110.844 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 76.1 Cg_endo -88.58 132.81 2.57 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.905 2.403 . . . . 0.0 113.125 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -96.1 135.27 38.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.267 173.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.428 ' HA ' ' CD2' ' A' ' 15' ' ' TYR . 25.7 p -87.82 -6.57 58.06 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.157 0.503 . . . . 0.0 110.92 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -81.76 -8.7 59.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.357 178.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.6 p -105.0 18.29 22.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.786 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.428 ' CD2' ' HA ' ' A' ' 12' ' ' THR . 21.9 m-30 -100.93 171.22 7.78 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -117.55 104.93 11.54 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -66.11 117.13 8.0 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.312 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -97.14 130.56 44.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.153 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -84.21 -23.62 30.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.873 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.0 t -73.33 -30.18 63.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.208 -178.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.9 m -107.57 -30.25 8.72 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.065 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.91 8.15 67.51 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.475 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -119.86 165.13 15.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.85 0.357 . . . . 0.0 110.725 -176.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -88.27 111.6 21.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.711 175.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.69 128.96 36.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.67 101.02 10.65 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.979 174.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -67.14 -17.23 50.42 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.917 2.411 . . . . 0.0 112.341 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -65.9 -58.99 4.31 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.855 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.65 -34.6 9.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.046 -177.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 37.61 1.92 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.458 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 83.2 mt -119.12 178.84 4.36 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.872 0.368 . . . . 0.0 110.588 -174.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -127.11 125.08 40.63 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.012 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -91.17 123.41 34.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.96 114.97 62.77 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.141 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -66.82 -12.67 36.93 Favored 'Trans proline' 0 C--O 1.233 0.236 0 C-N-CA 122.584 2.189 . . . . 0.0 112.209 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -87.02 -53.09 5.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.811 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.5 ' HB2' ' HD2' ' A' ' 39' ' ' TYR . 37.1 p -89.6 -20.03 24.23 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.094 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 68.9 26.53 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.291 0.636 . . . . 0.0 110.78 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . 0.5 ' HD2' ' HB2' ' A' ' 37' ' ' SER . 63.2 m-85 -115.29 166.14 12.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.415 176.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -98.69 142.27 30.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.356 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -116.73 118.75 33.41 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.72 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.4 t-20 -79.39 114.13 18.08 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 t -74.49 -13.31 60.67 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.941 -0.303 . . . . 0.0 111.065 -174.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -87.46 -50.97 6.19 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.774 0.321 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.0 p -96.27 -13.03 23.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.634 -175.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 65.34 35.42 7.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.25 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -107.89 174.57 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.01 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -116.23 145.61 42.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.939 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.806 HD21 ' HA ' ' A' ' 60' ' ' PRO . 13.9 mt -138.54 170.19 16.44 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.322 -177.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.485 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 37.6 p90 -148.3 146.38 28.55 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -82.51 114.47 20.95 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.697 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -98.34 121.17 39.94 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.43 -18.08 79.44 Favored Glycine 0 N--CA 1.452 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 113.303 -172.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -86.83 -40.4 14.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.151 0.5 . . . . 0.0 109.918 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -89.17 -11.09 44.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.581 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 60.82 41.02 15.18 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.805 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.601 HG23 HG13 ' A' ' 59' ' ' VAL . 8.8 t -155.58 152.62 29.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.757 0.313 . . . . 0.0 111.058 -176.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -83.15 106.22 14.77 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.601 HG13 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -101.46 138.04 19.79 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.53 -172.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.806 ' HA ' HD21 ' A' ' 49' ' ' LEU . 33.1 Cg_exo -57.83 122.72 12.23 Favored 'Trans proline' 0 CA--C 1.515 -0.448 0 C-N-CA 123.175 2.583 . . . . 0.0 112.9 -175.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.695 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.908 179.25 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.546 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.6 m -54.38 128.67 59.93 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 120.982 0.42 . . . . 0.0 111.139 178.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -86.42 132.09 3.61 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 122.566 2.178 . . . . 0.0 112.622 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -94.91 128.85 41.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.257 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.522 HG22 ' CE2' ' A' ' 15' ' ' TYR . 42.4 p -81.21 -4.77 56.51 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.428 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -70.56 -26.19 63.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.095 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -94.42 12.12 28.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.844 0.354 . . . . 0.0 111.416 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.522 ' CE2' HG22 ' A' ' 12' ' ' THR . 18.2 m-30 -86.4 167.11 15.02 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -114.71 111.5 21.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.687 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -68.31 120.27 14.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.99 0.424 . . . . 0.0 110.508 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -98.42 121.61 40.57 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 176.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -84.13 -18.37 37.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.152 0.501 . . . . 0.0 111.387 -175.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -86.72 -24.45 25.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.3 t -101.64 -30.81 11.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.285 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 8.09 75.38 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.668 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.533 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 68.2 m-85 -123.76 160.76 26.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 0.0 111.048 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.425 ' HE1' ' HB3' ' A' ' 35' ' ' PRO . 72.4 m-85 -86.86 111.33 20.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.082 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -74.51 124.13 26.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.987 0.422 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.477 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 13.5 t70 -94.84 116.51 66.44 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.073 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 3.0 Cg_endo -84.65 -13.72 6.9 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.042 2.495 . . . . 0.0 111.9 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -68.66 -53.78 20.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.554 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.75 -36.75 8.17 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.642 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 105.22 40.0 2.17 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.243 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.7 mt -121.11 173.3 7.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.863 0.363 . . . . 0.0 110.646 -173.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.458 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 44.5 m-85 -115.07 125.38 53.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.405 175.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.409 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 59.6 t80 -92.44 117.01 29.49 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . 0.533 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 10.3 t70 -77.13 111.85 19.34 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.425 ' HB3' ' HE1' ' A' ' 24' ' ' TYR . 27.4 Cg_endo -67.03 -19.44 51.65 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.302 2.001 . . . . 0.0 113.38 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -89.83 -49.1 6.82 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.686 0.279 . . . . 0.0 111.104 -175.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.1 m -93.76 -17.05 23.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 111.373 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 63.46 37.38 10.66 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.942 178.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -114.56 161.22 18.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.399 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -97.33 137.75 35.85 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.332 178.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . 0.458 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 45.8 t80 -111.36 117.79 34.07 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.917 -179.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.433 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 47.1 t-20 -79.12 113.1 16.98 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.3 t -77.08 -15.06 59.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.752 -0.203 . . . . 0.0 111.511 -174.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 tp -91.53 -43.2 9.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.973 0.415 . . . . 0.0 110.7 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 m -97.61 -13.46 21.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.3 0.572 . . . . 0.0 111.133 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 62.88 43.58 6.8 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.041 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.433 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 15.3 pt20 -122.5 166.59 14.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.014 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -108.94 141.47 40.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 110.865 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.614 HD23 ' HA ' ' A' ' 60' ' ' PRO . 14.1 mt -135.2 164.98 26.46 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.412 -172.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 42.3 p90 -140.01 145.69 38.1 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -76.98 123.3 26.13 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.161 176.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.98 120.38 41.62 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.73 -10.2 86.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.294 -174.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -97.09 -43.43 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -80.2 -18.27 50.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.36 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 58.68 48.54 11.47 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . 0.632 HG22 HG23 ' A' ' 59' ' ' VAL . 9.9 t -159.05 156.64 29.61 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.451 -175.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -85.07 108.32 17.59 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 171.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.632 HG23 HG22 ' A' ' 57' ' ' THR . 0.2 OUTLIER -102.1 143.44 26.61 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.535 -173.702 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' PRO . . . . . 0.614 ' HA ' HD23 ' A' ' 49' ' ' LEU . 45.7 Cg_exo -56.06 130.22 39.09 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.684 2.256 . . . . 0.0 111.955 177.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.751 -176.688 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.641 0 N-CA-C 112.285 -0.326 . . . . 0.0 112.285 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 70.42 -62.17 0.44 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.531 0.732 . . . . 0.0 111.793 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.2 mmt -93.38 47.26 1.24 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.958 0.408 . . . . 0.0 110.77 -176.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.85 53.46 0.21 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.056 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.0 p -69.21 97.72 0.95 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.048 0.452 . . . . 0.0 111.24 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -95.79 -43.7 7.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.236 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.719 ' HB3' ' HH2' ' A' ' 51' ' ' TRP . 69.8 m-85 -131.5 97.83 4.34 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.574 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.72 174.72 7.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.344 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.612 HG11 ' HE1' ' A' ' 51' ' ' TRP . 16.8 m -67.18 118.34 54.96 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.144 0.497 . . . . 0.0 110.805 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -71.51 131.62 19.13 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.262 1.974 . . . . 0.0 112.035 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.445 ' OD2' HG21 ' A' ' 14' ' ' THR . 9.1 p-10 -105.51 120.8 42.54 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.5 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 29.0 p -71.09 7.11 1.32 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.69 -176.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.414 ' H ' ' C ' ' A' ' 11' ' ' ASP . 13.1 m -86.25 -12.46 49.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 175.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.445 HG21 ' OD2' ' A' ' 11' ' ' ASP . 40.0 p -99.77 11.22 39.81 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.162 0.506 . . . . 0.0 110.521 173.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.5 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -92.95 169.34 10.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.843 -177.463 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -119.51 103.94 9.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.438 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 92.5 t80 -65.54 117.56 8.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.096 0.474 . . . . 0.0 110.638 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -93.73 105.9 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -71.6 -26.83 62.75 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.008 0.432 . . . . 0.0 111.123 -173.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -73.73 -28.3 61.64 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.854 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.1 t -100.88 -31.18 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.924 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.36 11.58 60.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.193 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -123.13 157.53 32.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.747 0.308 . . . . 0.0 110.765 -177.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.611 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.0 m-85 -87.28 116.22 25.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -74.36 128.1 34.7 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.288 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.456 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 8.9 t70 -102.51 98.9 11.72 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.696 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -13.44 24.69 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.805 2.337 . . . . 0.0 112.413 172.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -47.28 70.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.058 0.456 . . . . 0.0 110.649 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.7 m -114.38 -41.09 3.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.49 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.9 38.67 0.87 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -178.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.7 mt -123.83 176.59 6.2 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.113 0.482 . . . . 0.0 110.911 -175.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -115.16 125.31 53.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.365 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.611 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 84.3 t80 -93.52 121.15 34.63 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.288 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.76 112.64 41.69 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.583 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.8 Cg_endo -63.06 -23.56 73.66 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.731 2.287 . . . . 0.0 113.341 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -87.18 -49.49 7.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 -174.412 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.2 m -86.77 -20.59 27.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.119 -177.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 66.38 32.43 7.61 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.426 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -119.54 162.21 19.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.383 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -95.76 140.26 30.82 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.349 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -114.5 120.15 39.28 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.006 -176.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.427 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 48.2 t-20 -83.21 112.87 20.24 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.9 t -74.54 -13.55 60.69 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -173.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.9 tp -89.76 -46.45 8.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -99.19 -5.78 29.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.24 0.543 . . . . 0.0 110.976 -176.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 61.67 30.38 18.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.195 176.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.442 ' NE2' HD22 ' A' ' 49' ' ' LEU . 21.1 pt20 -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.795 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -113.68 140.72 48.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.831 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.537 HD23 ' HA ' ' A' ' 60' ' ' PRO . 19.5 mt -136.11 165.06 26.58 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.478 -173.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 39.3 p90 -140.98 156.84 45.98 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 174.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.719 ' HH2' ' HB3' ' A' ' 7' ' ' TYR . 72.0 t-105 -88.99 125.6 35.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.878 0.37 . . . . 0.0 111.013 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -103.99 124.41 48.96 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.33 -20.63 79.37 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.314 -173.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -85.98 -50.93 6.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.821 0.311 . . . . 0.0 110.74 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.12 -18.65 60.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.262 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 56.86 48.7 15.5 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.407 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -156.32 169.57 24.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.497 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.83 118.62 36.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.857 178.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.67 HG13 ' HD2' ' A' ' 60' ' ' PRO . 0.9 OUTLIER -107.09 144.95 30.16 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -177.748 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.67 ' HD2' HG13 ' A' ' 59' ' ' VAL . 39.8 Cg_exo -55.16 122.4 11.63 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.631 2.221 . . . . 0.0 112.119 178.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.55 -29.89 63.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.047 -177.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -75.65 87.8 2.74 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.11 91.04 0.07 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.277 -175.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 C--O 1.251 1.166 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.279 179.862 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.81 -50.96 0.21 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.889 0.376 . . . . 0.0 110.808 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 86.1 mtp -110.29 99.17 8.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.338 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 145.59 168.1 12.89 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.0 p -83.51 -173.11 4.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.739 0.269 . . . . 0.0 110.581 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -63.12 -54.07 43.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.155 0.502 . . . . 0.0 109.858 176.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -133.94 101.26 5.0 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.456 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.58 179.54 5.35 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.531 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.662 HG12 ' HE1' ' A' ' 51' ' ' TRP . 10.0 m -64.93 115.64 22.69 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.181 0.515 . . . . 0.0 110.581 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -64.25 132.54 34.26 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.411 2.74 . . . . 0.0 114.056 -172.073 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -100.65 119.46 38.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.049 174.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 25.3 p -69.66 -10.95 60.32 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.923 0.392 . . . . 0.0 111.778 -175.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 t -69.46 -18.49 63.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.926 175.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.1 p -95.98 9.31 41.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.911 0.386 . . . . 0.0 110.882 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.44 ' HH ' ' HE2' ' A' ' 40' ' ' TYR . 9.0 m-30 -91.34 164.5 13.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.191 0.519 . . . . 0.0 111.199 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -117.57 104.66 11.27 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.647 176.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 60.8 t80 -62.58 113.38 2.94 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.563 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -87.93 96.26 10.42 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.61 -18.28 64.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.087 0.47 . . . . 0.0 111.318 -175.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.8 t -86.51 -15.03 41.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.368 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -108.98 -30.57 8.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.136 0.493 . . . . 0.0 110.452 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.63 11.15 58.39 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.352 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.39 158.22 43.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.821 0.343 . . . . 0.0 110.61 -177.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.453 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 63.8 m-85 -79.31 117.76 20.6 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.938 174.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.528 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 61.8 t80 -76.8 122.04 24.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.819 0.342 . . . . 0.0 110.533 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.536 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -83.62 103.06 2.34 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.414 173.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.528 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 5.9 Cg_exo -78.51 -15.21 14.03 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.632 2.221 . . . . 0.0 110.972 -178.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 p -75.26 -49.26 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.704 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 m -105.83 -28.52 10.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.988 0.423 . . . . 0.0 111.914 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.42 41.25 3.47 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.677 -176.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.536 ' H ' ' HB2' ' A' ' 26' ' ' ASP . 81.9 mt -125.12 -170.89 2.25 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -175.193 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 52.1 m-85 -136.82 124.79 22.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.223 174.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -90.74 121.79 32.93 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -87.22 115.46 62.76 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.834 175.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -60.94 -24.67 79.93 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 122.616 2.211 . . . . 0.0 112.788 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -84.2 -53.22 5.66 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.06 -175.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.479 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 19.2 m -80.15 -23.0 41.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.889 0.376 . . . . 0.0 111.487 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 65.97 25.73 10.99 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.659 -175.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.479 ' HD2' ' HB3' ' A' ' 37' ' ' SER . 60.1 m-85 -114.17 167.63 10.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.142 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.44 ' HE2' ' HH ' ' A' ' 15' ' ' TYR . 93.5 m-85 -101.27 144.99 29.44 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.526 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -116.91 113.72 22.84 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.045 -178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.46 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 53.9 t-20 -75.54 104.03 5.92 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -19.61 60.97 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.892 0.377 . . . . 0.0 110.903 -174.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.6 tp -79.84 -41.7 25.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.964 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -101.72 -12.2 18.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.365 0.602 . . . . 0.0 111.113 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 62.93 63.65 0.93 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.995 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.46 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 19.6 pt20 -148.15 168.34 22.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.224 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.417 ' HA ' ' O ' ' A' ' 40' ' ' TYR . 26.8 m-85 -113.65 143.33 44.76 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.378 0.609 . . . . 0.0 111.581 -178.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.543 HD23 ' HA ' ' A' ' 60' ' ' PRO . 30.2 mt -140.02 169.31 17.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.591 -172.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -142.02 144.86 33.85 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 171.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.662 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.1 t-105 -77.42 113.34 15.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.202 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.455 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 14.1 t70 -97.28 117.55 31.76 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.41 -24.88 75.93 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.163 -0.541 . . . . 0.0 112.853 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.455 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 29.9 tt0 -71.33 -47.72 54.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.334 0.588 . . . . 0.0 110.547 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 mttp -87.06 -14.95 40.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.702 -176.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 59.41 41.84 18.87 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.535 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.574 HG23 HG12 ' A' ' 59' ' ' VAL . 13.0 t -150.96 155.59 39.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.526 -177.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -87.27 105.25 17.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.574 HG12 HG23 ' A' ' 57' ' ' THR . 1.1 m -100.46 148.18 34.6 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.628 -176.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.543 ' HA ' HD23 ' A' ' 49' ' ' LEU . 31.8 Cg_exo -58.87 128.72 29.01 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.096 2.531 . . . . 0.0 112.867 -177.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.97 -7.71 57.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.433 176.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.28 90.23 7.86 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.294 177.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -84.86 -13.8 49.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.443 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.247 0.929 0 CA-C-O 118.598 -0.715 . . . . 0.0 110.216 177.86 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 71.9 139.57 0.05 Allowed 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.243 0.617 . . . . 0.0 111.638 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 87.9 mtp 65.61 26.25 11.6 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.805 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.67 -91.14 1.31 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.287 179.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.54 90.75 3.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.468 0.652 . . . . 0.0 110.736 178.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.438 ' HE2' ' HB2' ' A' ' 6' ' ' LYS . 31.9 mtmm -98.54 -49.22 4.71 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.779 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -131.94 108.25 9.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.366 177.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -104.97 -169.26 1.58 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.175 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.484 HG12 ' HE1' ' A' ' 51' ' ' TRP . 16.9 m -60.09 119.73 44.52 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.291 0.567 . . . . 0.0 110.827 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.582 ' HG2' ' HH ' ' A' ' 40' ' ' TYR . 73.9 Cg_endo -81.24 132.77 8.37 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.714 2.276 . . . . 0.0 112.673 -177.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.409 ' OD2' ' HB2' ' A' ' 13' ' ' SER . 23.0 t70 -96.95 127.23 42.72 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.179 178.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.0 p -87.02 -7.69 57.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -174.14 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.409 ' HB2' ' OD2' ' A' ' 11' ' ' ASP . 27.9 m -71.01 -39.41 72.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.167 0.508 . . . . 0.0 109.878 178.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 t -84.35 8.28 16.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.202 -178.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.558 ' HE2' ' HE1' ' A' ' 40' ' ' TYR . 7.5 m-30 -80.02 161.58 25.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.226 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -104.65 104.15 13.92 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.621 -175.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -60.94 112.95 2.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.312 0.577 . . . . 0.0 111.324 -175.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -82.89 96.78 8.37 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -22.52 59.75 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.18 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.4 m -81.1 -19.39 43.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.089 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.8 t -109.92 -30.39 7.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.061 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.19 37.22 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.58 ' HB2' ' HD1' ' A' ' 32' ' ' TYR . 95.1 m-85 -136.14 161.43 35.76 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.578 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.4 m-85 -81.2 116.33 21.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 175.74 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -74.7 129.47 37.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.032 0.444 . . . . 0.0 110.263 177.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.9 t70 -102.83 99.36 13.48 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.206 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 56.8 Cg_endo -72.68 -11.82 26.3 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.078 2.519 . . . . 0.0 112.446 175.346 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.96 -58.18 3.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.9 m -101.1 -39.86 7.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.062 0.458 . . . . 0.0 110.349 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 114.34 40.96 0.91 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 80.6 mt -124.06 173.5 8.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.994 0.426 . . . . 0.0 111.4 -175.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.58 ' HD1' ' HB2' ' A' ' 23' ' ' TYR . 20.1 m-85 -112.69 125.31 54.16 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.227 174.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.578 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 85.4 t80 -96.71 120.11 36.42 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.54 ' HA ' ' HD2' ' A' ' 23' ' ' TYR . 21.8 t0 -84.1 114.28 53.37 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 175.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -61.76 -23.39 76.13 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.408 HD22 ' HA ' ' A' ' 36' ' ' ASN . 3.3 t-20 -83.9 -53.27 5.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.944 0.402 . . . . 0.0 111.156 -176.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -82.62 -21.3 35.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.214 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 65.45 30.33 10.88 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.882 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.401 ' HD2' ' HB3' ' A' ' 50' ' ' TYR . 30.9 m-85 -116.23 158.78 22.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.275 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.582 ' HH ' ' HG2' ' A' ' 10' ' ' PRO . 90.1 m-85 -96.09 137.65 34.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.305 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -110.53 115.83 30.3 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.047 -178.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.8 t-20 -78.51 110.52 13.68 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -72.25 -26.64 62.08 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.823 0.344 . . . . 0.0 111.041 -175.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.1 tp -80.63 -44.2 19.26 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.892 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.3 m -98.6 -7.36 28.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.418 0.628 . . . . 0.0 111.215 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 59.56 43.44 15.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.522 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -124.95 162.51 24.31 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.621 -176.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -107.19 139.36 41.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.223 0.535 . . . . 0.0 110.908 178.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.638 HD22 ' HA ' ' A' ' 60' ' ' PRO . 27.0 mt -137.52 166.3 24.22 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.825 -174.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.694 ' HD1' ' HB3' ' A' ' 61' ' ' ALA . 43.2 p90 -146.85 146.92 30.37 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.484 ' HE1' HG12 ' A' ' 9' ' ' VAL . 59.5 t-105 -80.26 116.48 20.37 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.372 -179.04 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.5 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 12.5 t70 -100.56 113.13 25.7 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 172.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.77 -23.62 69.23 Favored Glycine 0 N--CA 1.453 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.543 -173.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -75.73 -48.32 22.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.036 0.446 . . . . 0.0 110.078 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.5 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 26.1 mmmt -79.26 -18.22 53.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.059 -176.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 61.9 38.64 14.36 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.441 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.465 HG23 HG12 ' A' ' 59' ' ' VAL . 7.4 t -149.76 162.36 40.41 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.528 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -92.62 108.78 20.24 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.465 HG12 HG23 ' A' ' 57' ' ' THR . 3.7 m -103.26 140.0 20.65 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.837 -173.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.638 ' HA ' HD22 ' A' ' 49' ' ' LEU . 52.9 Cg_exo -56.27 122.97 12.73 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.338 2.692 . . . . 0.0 112.778 -176.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.694 ' HB3' ' HD1' ' A' ' 50' ' ' TYR . . . -99.73 -2.8 34.36 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.577 -177.968 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -146.68 42.9 1.17 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.741 0.305 . . . . 0.0 111.357 -178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -75.65 -17.97 59.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.077 0.465 . . . . 0.0 110.16 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.7 m . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.604 176.857 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.26 53.03 10.56 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.096 0.474 . . . . 0.0 111.344 179.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.2 ptm -137.45 18.19 2.92 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.901 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.74 52.39 3.55 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.602 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.9 m -79.75 125.17 29.33 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 121.125 0.488 . . . . 0.0 110.826 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -102.84 -41.26 6.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.672 0.749 . . . . 0.0 109.503 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -113.32 128.56 56.5 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.626 -178.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.01 -173.63 2.35 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.8 m -54.84 119.16 20.08 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.372 0.606 . . . . 0.0 109.983 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.46 132.55 12.39 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.678 2.252 . . . . 0.0 113.402 -170.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -81.29 133.06 35.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.279 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.429 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 12.6 p -94.65 -14.99 24.36 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.072 0.463 . . . . 0.0 110.741 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -76.0 -17.9 59.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.666 177.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.7 p -89.72 0.77 56.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.429 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 21.4 m-30 -85.18 158.87 20.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.551 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -100.86 103.56 14.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.745 -0.662 . . . . 0.0 109.477 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -66.82 116.68 7.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.809 0.338 . . . . 0.0 110.576 -177.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -96.01 113.44 25.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.9 -16.99 56.29 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.209 0.528 . . . . 0.0 111.522 -175.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.4 t -88.37 -19.29 26.82 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.893 -179.032 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.5 t -105.29 -30.5 9.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.305 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.02 22.71 44.2 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.3 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 86.7 m-85 -139.23 156.05 47.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.017 0.437 . . . . 0.0 111.082 -176.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.433 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 62.7 m-85 -82.07 110.85 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.918 171.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -74.66 126.84 31.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.66 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -97.95 102.21 12.98 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.07 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.57 -16.97 48.15 Favored 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 123.141 2.561 . . . . 0.0 112.801 175.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 m -69.61 -65.79 0.67 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.874 0.369 . . . . 0.0 110.809 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -33.72 15.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.413 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.88 41.53 1.96 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.291 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.512 HD23 ' HA ' ' A' ' 42' ' ' ASN . 95.7 mt -121.88 176.19 5.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.302 . . . . 0.0 110.631 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -123.9 125.77 45.21 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.084 174.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.433 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 87.6 t80 -96.2 125.68 40.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.534 0.207 . . . . 0.0 110.448 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -89.3 117.36 68.13 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 175.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -66.99 -19.72 51.61 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.531 2.154 . . . . 0.0 112.726 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -86.57 -51.18 6.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.81 0.338 . . . . 0.0 111.148 -176.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.4 m -82.55 -19.77 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.193 0.521 . . . . 0.0 110.891 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 63.34 30.72 15.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.956 -177.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -119.55 163.86 16.69 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.999 177.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -97.42 153.12 18.31 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.433 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -124.22 121.86 36.22 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.785 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.512 ' HA ' HD23 ' A' ' 31' ' ' LEU . 45.0 t-20 -78.68 116.41 19.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 m -66.21 -25.45 66.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.822 -172.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.5 -50.49 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.828 0.347 . . . . 0.0 111.416 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.1 m -87.08 -13.94 42.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.556 0.693 . . . . 0.0 110.896 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 60.69 39.51 17.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.106 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -113.67 168.29 9.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.162 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -105.67 140.53 38.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.457 0.646 . . . . 0.0 111.233 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.682 HD22 ' HA ' ' A' ' 60' ' ' PRO . 11.9 mt -134.94 171.22 14.71 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.312 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.446 ' CE1' HG21 ' A' ' 59' ' ' VAL . 32.6 p90 -148.01 153.79 39.42 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 173.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 59.5 t-105 -83.7 122.37 28.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.911 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -106.86 124.17 49.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 172.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -73.94 -15.01 79.82 Favored Glycine 0 N--CA 1.454 -0.157 0 C-N-CA 121.02 -0.609 . . . . 0.0 113.168 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -87.54 -47.98 8.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.703 0.287 . . . . 0.0 110.527 -177.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -81.4 -15.17 56.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.059 0.457 . . . . 0.0 110.825 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.66 41.45 15.16 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.376 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.8 t -158.6 169.39 24.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.861 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -91.92 112.27 24.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.446 HG21 ' CE1' ' A' ' 50' ' ' TYR . 2.5 m -106.56 146.84 33.84 Favored Pre-proline 0 C--N 1.318 -0.774 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.328 -176.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.682 ' HA ' HD22 ' A' ' 49' ' ' LEU . 38.8 Cg_exo -57.25 122.76 12.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.968 2.445 . . . . 0.0 113.023 -175.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -79.52 -12.79 59.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.882 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -107.49 31.66 5.26 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.262 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.5 112.94 13.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.736 177.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.462 -0.78 . . . . 0.0 110.189 178.907 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.27 7.52 46.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.819 0.342 . . . . 0.0 111.178 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 66.5 mtt -85.8 68.5 10.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.159 0.504 . . . . 0.0 110.343 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -149.55 29.78 1.17 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.968 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.8 m -72.76 129.63 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.4 mttp -128.52 -74.46 0.57 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.177 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -94.61 131.51 40.3 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.437 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -128.16 176.54 7.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.978 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 32.5 m -60.33 133.75 90.87 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.46 . . . . 0.0 110.929 178.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -85.58 152.99 10.34 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.017 2.478 . . . . 0.0 112.904 -178.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.666 ' O ' ' HB ' ' A' ' 14' ' ' THR . 12.7 t70 -121.9 127.06 50.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.485 176.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.451 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 67.7 p -86.85 5.7 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -170.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.1 t -87.17 -23.42 24.82 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 172.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.666 ' HB ' ' O ' ' A' ' 11' ' ' ASP . 1.8 m -75.3 -17.95 60.16 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.948 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.451 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -78.07 164.06 25.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.338 -177.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -112.21 102.81 10.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.63 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.512 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . 89.6 t80 -72.57 128.19 34.83 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.838 0.351 . . . . 0.0 111.697 -174.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -108.55 130.36 55.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.172 172.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.0 -24.09 30.7 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.218 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -24.73 56.48 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.37 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.6 t -111.8 -30.27 7.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.408 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.12 23.96 46.45 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.541 -0.838 . . . . 0.0 111.934 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -125.75 155.5 40.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.896 0.379 . . . . 0.0 110.441 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.617 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 70.6 m-85 -88.24 114.06 24.48 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.428 169.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -73.84 132.97 43.1 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.932 0.396 . . . . 0.0 110.369 -177.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -104.1 97.78 12.28 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.606 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -72.26 -12.89 28.03 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.875 2.384 . . . . 0.0 112.057 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -51.9 65.0 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.768 -178.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.6 m -117.19 -41.14 3.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.933 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.21 38.57 0.55 Allowed Glycine 0 CA--C 1.509 -0.34 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -115.01 175.68 5.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.139 0.495 . . . . 0.0 111.11 -174.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -123.33 125.22 44.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.799 171.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.598 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.8 t80 -93.06 122.94 35.94 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.602 0.239 . . . . 0.0 110.434 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -85.17 111.35 35.55 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.617 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 16.3 Cg_endo -63.98 -25.87 66.6 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.421 2.081 . . . . 0.0 113.549 -176.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -89.29 -43.75 10.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 0.0 111.294 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.1 m -88.22 -18.08 29.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -177.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 63.08 25.54 15.0 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.89 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -107.85 167.6 9.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 174.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.79 139.57 39.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.274 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 47.0 t80 -109.11 114.39 28.07 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.573 -179.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.462 ' HB2' HD12 ' A' ' 49' ' ' LEU . 47.0 t-20 -73.57 113.45 10.7 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.39 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.9 t -73.06 -17.34 61.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.427 . . . . 0.0 110.971 -176.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 tp -87.94 -51.38 5.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.995 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -94.68 -14.32 24.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.364 -174.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 63.12 46.98 4.36 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.141 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -129.79 163.9 25.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.927 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -99.3 139.19 35.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.581 . . . . 0.0 111.131 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.539 HD23 ' HA ' ' A' ' 60' ' ' PRO . 15.3 mt -137.46 168.09 20.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.741 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -144.27 149.94 37.11 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -79.34 117.77 20.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.734 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.53 ' OD2' ' HG3' ' A' ' 55' ' ' LYS . 16.3 t70 -103.12 124.7 49.06 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 172.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.36 -12.02 84.72 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -80.63 -52.1 7.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.013 0.435 . . . . 0.0 109.894 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.53 ' HG3' ' OD2' ' A' ' 52' ' ' ASP . 66.1 mttm -77.33 -18.57 57.35 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.3 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 62.05 43.73 8.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.401 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -158.29 170.91 21.19 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -96.7 112.76 24.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.67 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 1.7 m -109.42 152.9 42.96 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.829 -177.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.539 ' HA ' HD23 ' A' ' 49' ' ' LEU . 11.9 Cg_endo -55.72 128.58 30.94 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.219 2.613 . . . . 0.0 112.663 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -98.54 0.65 45.42 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.416 -177.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -142.33 81.0 1.73 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.835 -179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -100.07 -36.62 9.29 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.309 -0.853 . . . . 0.0 109.895 175.745 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.631 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.41 -60.23 2.27 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.848 -0.426 . . . . 0.0 109.848 176.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 45.6 ttp 52.46 53.84 11.64 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.44 0.638 . . . . 0.0 111.161 174.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.63 29.7 2.65 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.915 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.9 p -90.22 88.01 7.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.215 0.531 . . . . 0.0 111.564 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -82.98 -37.07 24.54 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 176.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.82 101.18 4.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.249 174.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.38 -174.5 2.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.228 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.478 HG12 ' HE1' ' A' ' 51' ' ' TRP . 29.6 m -60.66 131.59 91.07 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.18 0.514 . . . . 0.0 111.077 -178.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -89.37 132.53 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.958 2.439 . . . . 0.0 112.951 -178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -91.96 128.07 37.66 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.466 175.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.557 ' HA ' ' CD2' ' A' ' 15' ' ' TYR . 42.8 p -84.24 -11.58 56.22 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.089 0.471 . . . . 0.0 111.432 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -73.46 -13.99 61.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.902 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.5 p -103.11 18.07 22.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.06 0.457 . . . . 0.0 111.093 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.557 ' CD2' ' HA ' ' A' ' 12' ' ' THR . 19.6 m-30 -98.72 171.72 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.657 178.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -109.34 103.49 12.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.037 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.01 118.67 6.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.169 0.509 . . . . 0.0 110.724 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -94.91 110.02 21.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.387 -0.824 . . . . 0.0 108.986 178.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.21 -23.75 60.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.443 -174.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.7 t -77.13 -28.16 54.18 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.181 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 m -102.06 -30.76 10.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.07 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.82 6.05 76.8 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.509 -178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.423 ' CE2' ' HB2' ' A' ' 34' ' ' ASP . 10.0 m-85 -114.25 161.38 17.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.307 -0.446 . . . . 0.0 110.19 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -89.44 115.67 27.05 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.599 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 81.6 t80 -74.78 121.86 22.42 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.763 -177.595 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.444 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.8 OUTLIER -80.02 103.44 1.72 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.975 174.333 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.599 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 2.0 Cg_endo -80.85 -19.95 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.453 2.102 . . . . 0.0 110.67 177.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -85.08 -31.65 23.25 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.598 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.6 -18.62 13.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.264 -173.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.91 30.81 58.84 Favored Glycine 0 N--CA 1.454 -0.143 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.826 HD22 ' HA ' ' A' ' 42' ' ' ASN . 71.0 mt -125.46 -175.83 3.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.367 . . . . 0.0 110.559 -173.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.556 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 53.3 m-85 -125.62 125.1 42.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.74 171.332 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -91.38 121.62 33.27 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.423 ' HB2' ' CE2' ' A' ' 23' ' ' TYR . 33.9 t0 -83.17 117.8 69.72 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 175.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -67.66 -18.23 48.13 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.159 1.906 . . . . 0.0 112.414 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -86.93 -53.24 5.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.938 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.643 ' HB2' ' HD1' ' A' ' 39' ' ' TYR . 68.0 p -89.08 -21.5 23.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.856 0.36 . . . . 0.0 111.525 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 68.11 23.96 7.86 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.52 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.643 ' HD1' ' HB2' ' A' ' 37' ' ' SER . 74.8 m-85 -102.32 159.32 15.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.575 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.66 139.55 33.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.12 0.486 . . . . 0.0 110.569 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.556 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 64.4 t80 -110.37 116.49 31.53 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.038 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.826 ' HA ' HD22 ' A' ' 31' ' ' LEU . 45.7 t-20 -74.85 108.44 7.59 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 m -64.1 -27.03 68.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.874 0.369 . . . . 0.0 111.511 -174.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.8 tp -78.15 -50.97 10.96 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.486 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.6 m -95.7 -8.63 34.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.343 0.592 . . . . 0.0 111.229 -172.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 61.66 40.06 13.69 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.931 0.872 . . . . 0.0 109.469 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.518 ' HG3' ' HG2' ' A' ' 63' ' ' GLU . 26.9 tt0 -111.31 165.85 11.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.218 -172.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -119.41 138.92 52.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.456 0.646 . . . . 0.0 111.34 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.658 HD23 ' HA ' ' A' ' 60' ' ' PRO . 20.0 mt -135.81 174.47 10.58 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.645 -176.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.56 ' HD2' ' HB2' ' A' ' 61' ' ' ALA . 46.6 p90 -149.96 146.85 27.27 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.478 ' HE1' HG12 ' A' ' 9' ' ' VAL . 65.1 t-105 -79.7 112.94 17.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.835 0.35 . . . . 0.0 110.204 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.409 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 9.7 t70 -91.63 114.85 27.5 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.71 -14.19 82.77 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.85 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.409 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 26.6 tt0 -79.21 -48.15 14.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.397 0.618 . . . . 0.0 109.774 178.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.8 mttp -87.94 -19.08 27.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.773 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 59.47 61.92 1.89 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.593 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -164.73 164.67 21.2 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.177 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -96.86 108.04 20.65 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.272 0.558 . . . . 0.0 109.584 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -106.53 146.23 32.62 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.267 -176.672 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.658 ' HA ' HD23 ' A' ' 49' ' ' LEU . 41.8 Cg_endo -66.08 127.57 17.9 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.958 2.438 . . . . 0.0 112.551 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.56 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . . . -91.02 37.16 0.92 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.052 -178.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 67.77 109.8 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.989 0.806 . . . . 0.0 110.52 -175.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.518 ' HG2' ' HG3' ' A' ' 47' ' ' GLN . 33.6 mt-10 -73.12 -31.62 64.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.914 -173.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.931 175.386 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.783 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 3' ' ' MET . . . 73.24 -35.94 0.34 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.574 0.75 . . . . 0.0 112.63 178.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.425 ' HB2' ' O ' ' A' ' 2' ' ' ALA . 87.9 mmm 74.82 -32.23 0.22 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.599 0.759 . . . . 0.0 112.211 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.11 -19.34 59.28 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.12 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.431 HG22 ' HB1' ' A' ' 8' ' ' ALA . 7.8 m -86.54 74.66 9.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.745 0.783 . . . . 0.0 110.641 -178.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -96.58 -38.02 10.13 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 114.977 -1.011 . . . . 0.0 108.474 172.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -131.36 105.88 7.91 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.806 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.431 ' HB1' HG22 ' A' ' 5' ' ' THR . . . -103.23 -176.87 3.21 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.948 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.7 m -51.47 123.8 23.23 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.621 0.724 . . . . 0.0 111.716 179.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.599 ' HG2' ' HH ' ' A' ' 40' ' ' TYR . 74.2 Cg_endo -78.62 132.44 10.97 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.754 2.303 . . . . 0.0 112.664 -179.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -98.05 127.98 44.31 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 173.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.4 p -79.48 -7.17 58.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -177.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 m -81.08 -23.7 38.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.656 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 10.74 17.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.976 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.48 ' HH ' ' HB2' ' A' ' 10' ' ' PRO . 16.3 m-30 -93.7 162.48 13.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.849 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -107.49 112.32 25.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.581 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -69.56 125.9 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.944 0.402 . . . . 0.0 110.629 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -100.63 132.58 45.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.79 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -84.86 -33.41 22.85 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.585 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t -75.33 -28.79 59.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.261 0.553 . . . . 0.0 109.968 -174.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.3 m -107.0 -25.69 11.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.269 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.27 22.0 68.95 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.724 178.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -117.05 154.53 30.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.824 0.345 . . . . 0.0 110.555 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.778 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 73.3 m-85 -89.18 111.1 21.8 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.177 174.362 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -74.57 122.59 23.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.029 0.442 . . . . 0.0 111.004 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.429 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 5.6 t70 -94.52 111.4 53.76 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.273 175.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 2.0 Cg_endo -84.33 -11.73 8.26 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.446 2.764 . . . . 0.0 111.799 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.83 -52.59 14.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.856 -178.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 m -104.95 -38.74 6.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.267 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.38 38.28 1.51 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.423 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.1 mt -115.73 174.35 6.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 -174.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -123.13 125.83 45.88 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.819 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.778 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.3 t80 -90.41 127.16 36.12 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.908 0.385 . . . . 0.0 110.223 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 44.3 t0 -88.96 106.82 14.36 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.464 178.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.563 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 24.9 Cg_endo -66.83 -21.34 50.93 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.655 2.237 . . . . 0.0 112.416 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -89.04 -43.68 10.92 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.613 -174.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.1 m -92.65 -16.47 25.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.274 -178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 63.18 36.44 12.02 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.712 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -131.64 169.64 15.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.465 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . 0.599 ' HH ' ' HG2' ' A' ' 10' ' ' PRO . 94.3 m-85 -97.6 149.84 21.8 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.893 0.377 . . . . 0.0 110.505 179.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -119.12 121.15 39.12 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.599 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.494 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 46.7 t-20 -82.08 108.87 15.91 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 p -73.62 -12.78 60.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.903 0.382 . . . . 0.0 111.723 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.6 tp -90.63 -45.56 8.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.818 0.342 . . . . 0.0 111.121 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 m -99.19 -12.96 19.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.498 . . . . 0.0 111.322 -175.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 63.48 63.58 0.87 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.786 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.494 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 4.5 pt20 -146.2 162.81 37.21 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.112 -176.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.672 ' HB2' ' HB1' ' A' ' 62' ' ' ALA . 6.9 m-85 -103.5 137.48 41.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.275 0.559 . . . . 0.0 110.812 178.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.662 HD22 ' HA ' ' A' ' 60' ' ' PRO . 16.5 mt -133.55 165.46 24.83 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.837 -171.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.615 ' HD1' ' HB2' ' A' ' 61' ' ' ALA . 37.1 p90 -143.4 150.33 38.94 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 56.8 t-105 -87.42 120.53 28.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.883 0.373 . . . . 0.0 110.534 -178.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.462 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 13.0 t70 -102.02 124.02 46.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -66.42 -18.77 68.0 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 114.111 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -96.33 -41.49 8.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 117.316 0.558 . . . . 0.0 110.458 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.462 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 10.9 mmmm -73.7 -18.24 61.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -177.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 57.25 38.03 28.52 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.373 175.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.412 HG23 HG13 ' A' ' 59' ' ' VAL . 13.0 t -158.7 163.23 37.02 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.861 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -87.59 108.84 19.25 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.414 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -101.79 142.63 24.97 Favored Pre-proline 0 C--N 1.314 -0.973 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.265 -175.836 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.662 ' HA ' HD22 ' A' ' 49' ' ' LEU . 22.0 Cg_exo -65.07 122.49 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.863 2.376 . . . . 0.0 113.108 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.615 ' HB2' ' HD1' ' A' ' 50' ' ' TYR . . . -97.68 -35.17 10.66 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.517 178.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.672 ' HB1' ' HB2' ' A' ' 48' ' ' TYR . . . -125.23 100.22 6.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.472 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -110.37 140.45 44.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.045 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 p . . . . . 0 C--O 1.246 0.919 0 CA-C-O 119.093 -0.479 . . . . 0.0 110.638 -179.496 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.542 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.5 -38.2 12.67 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.848 0.356 . . . . 0.0 110.351 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 49.1 ttm -67.73 -38.55 83.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.301 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.09 -104.81 2.91 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.978 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.9 t -133.93 154.5 51.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.006 0.431 . . . . 0.0 110.917 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -125.88 -159.75 0.93 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -56.05 115.25 2.32 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 171.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -127.98 178.89 5.88 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.722 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.469 HG12 ' HE1' ' A' ' 51' ' ' TRP . 15.6 m -59.7 119.74 43.21 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 111.357 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -85.0 139.37 7.25 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -101.39 124.42 47.04 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.514 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 35.1 p -75.45 -12.02 60.16 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.567 -176.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -72.16 -23.72 61.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.759 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -96.57 18.13 14.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.887 0.375 . . . . 0.0 111.804 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.514 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 16.3 m-30 -93.28 171.6 8.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.706 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -109.68 103.91 12.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.237 179.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.64 123.64 21.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.916 0.389 . . . . 0.0 110.141 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -104.54 137.5 42.31 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.287 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -83.64 -29.55 27.59 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.571 -174.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.9 m -84.99 -30.12 24.47 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.071 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.5 t -95.59 -24.92 16.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.07 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 74.53 8.49 80.87 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.992 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.446 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 58.5 m-85 -118.46 166.37 12.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.056 0.455 . . . . 0.0 110.558 -179.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.627 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 80.1 m-85 -89.53 113.12 24.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.472 172.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -74.28 129.78 38.46 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.026 0.441 . . . . 0.0 110.591 -177.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.405 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.3 t70 -100.84 99.7 10.97 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.234 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 60.2 Cg_endo -74.19 -11.63 23.12 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 123.106 2.537 . . . . 0.0 112.54 174.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.19 -46.99 66.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.928 0.394 . . . . 0.0 110.81 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 m -116.16 -41.88 3.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.668 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.28 36.83 0.68 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.555 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 96.8 mt -117.83 178.08 4.54 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.882 0.372 . . . . 0.0 110.844 -175.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -122.73 125.49 45.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.04 175.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.525 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 82.3 t80 -92.97 121.33 34.2 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.446 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 22.9 t0 -85.55 114.16 55.0 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.307 -0.406 . . . . 0.0 109.987 176.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.627 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.1 Cg_endo -62.05 -21.59 72.68 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.618 2.212 . . . . 0.0 112.634 178.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -84.93 -53.29 5.41 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.928 -176.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.451 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 19.1 m -83.18 -19.46 36.51 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 66.25 29.58 9.55 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.598 0.561 . . . . 0.0 110.696 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.451 ' HD1' ' HB3' ' A' ' 37' ' ' SER . 52.4 m-85 -120.95 163.83 17.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.721 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -98.15 141.5 31.0 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.238 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -115.57 116.18 27.71 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.83 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.471 ' O ' ' HA ' ' A' ' 46' ' ' GLN . 44.4 t-20 -74.43 119.08 18.14 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.431 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -75.95 -16.73 59.96 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.7 tp -92.78 -57.71 2.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.982 0.42 . . . . 0.0 111.093 -179.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 m -87.17 -14.17 41.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.637 0.732 . . . . 0.0 110.885 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.471 ' HA ' ' O ' ' A' ' 42' ' ' ASN . 77.1 mt-30 60.02 47.84 9.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.576 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -119.32 169.36 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.627 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -109.7 138.25 46.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.502 0.668 . . . . 0.0 111.351 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.63 HD22 ' HA ' ' A' ' 60' ' ' PRO . 18.2 mt -134.99 169.55 17.24 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.319 -173.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.446 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 34.2 p90 -150.06 149.92 31.0 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . 0.469 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.0 t-105 -83.59 119.05 24.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.81 0.338 . . . . 0.0 110.347 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -104.23 133.91 48.35 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.949 174.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.79 -11.61 85.26 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.341 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -90.12 -49.42 6.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.168 0.508 . . . . 0.0 110.043 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -80.77 -18.09 48.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.568 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 46.38 61.99 2.5 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.438 0.637 . . . . 0.0 111.448 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.473 HG21 HG11 ' A' ' 59' ' ' VAL . 14.7 t -169.95 170.19 7.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.149 -0.932 . . . . 0.0 108.713 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -89.56 99.74 12.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.473 HG11 HG21 ' A' ' 57' ' ' THR . 3.3 m -95.7 145.55 29.75 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.458 -176.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.63 ' HA ' HD22 ' A' ' 49' ' ' LEU . 27.6 Cg_endo -62.27 122.93 11.57 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.659 2.239 . . . . 0.0 112.321 -177.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.18 -26.61 67.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.135 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -109.84 129.89 55.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.697 173.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -89.48 22.26 3.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.11 0.481 . . . . 0.0 110.968 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 m . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.146 177.89 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 111.861 -0.496 . . . . 0.0 111.861 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.65 50.2 2.24 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.077 0.465 . . . . 0.0 111.047 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.4 mmt -134.45 -65.93 0.62 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.15 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -169.36 85.79 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.2 p -66.19 109.52 2.66 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.26 0.552 . . . . 0.0 111.523 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -77.46 -46.65 21.89 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -136.35 110.49 8.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.192 176.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.88 178.33 4.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.062 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.417 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 29.9 m -63.62 137.62 97.14 Favored Pre-proline 0 C--O 1.236 0.368 0 CA-C-O 121.154 0.502 . . . . 0.0 110.844 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 76.1 Cg_endo -88.58 132.81 2.57 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.905 2.403 . . . . 0.0 113.125 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -96.1 135.27 38.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.267 173.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.428 ' HA ' ' CD2' ' A' ' 15' ' ' TYR . 25.7 p -87.82 -6.57 58.06 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.157 0.503 . . . . 0.0 110.92 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -81.76 -8.7 59.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.357 178.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.6 p -105.0 18.29 22.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.786 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.428 ' CD2' ' HA ' ' A' ' 12' ' ' THR . 21.9 m-30 -100.93 171.22 7.78 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -117.55 104.93 11.54 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -66.11 117.13 8.0 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.312 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -97.14 130.56 44.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.153 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -84.21 -23.62 30.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.873 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.0 t -73.33 -30.18 63.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.208 -178.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.9 m -107.57 -30.25 8.72 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.065 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.91 8.15 67.51 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.475 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -119.86 165.13 15.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.85 0.357 . . . . 0.0 110.725 -176.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -88.27 111.6 21.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.711 175.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.69 128.96 36.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.67 101.02 10.65 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.979 174.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -67.14 -17.23 50.42 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.917 2.411 . . . . 0.0 112.341 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -65.9 -58.99 4.31 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.855 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.65 -34.6 9.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.046 -177.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 37.61 1.92 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.458 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 83.2 mt -119.12 178.84 4.36 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.872 0.368 . . . . 0.0 110.588 -174.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -127.11 125.08 40.63 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.012 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -91.17 123.41 34.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.96 114.97 62.77 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.141 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -66.82 -12.67 36.93 Favored 'Trans proline' 0 C--O 1.233 0.236 0 C-N-CA 122.584 2.189 . . . . 0.0 112.209 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -87.02 -53.09 5.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.811 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.5 ' HB2' ' HD2' ' A' ' 39' ' ' TYR . 37.1 p -89.6 -20.03 24.23 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.094 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 68.9 26.53 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.291 0.636 . . . . 0.0 110.78 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . 0.5 ' HD2' ' HB2' ' A' ' 37' ' ' SER . 63.2 m-85 -115.29 166.14 12.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.415 176.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -98.69 142.27 30.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.356 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -116.73 118.75 33.41 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.72 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.4 t-20 -79.39 114.13 18.08 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 t -74.49 -13.31 60.67 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.941 -0.303 . . . . 0.0 111.065 -174.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -87.46 -50.97 6.19 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.774 0.321 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.0 p -96.27 -13.03 23.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.634 -175.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 65.34 35.42 7.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.25 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -107.89 174.57 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.01 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -116.23 145.61 42.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.939 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.806 HD21 ' HA ' ' A' ' 60' ' ' PRO . 13.9 mt -138.54 170.19 16.44 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.322 -177.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.485 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 37.6 p90 -148.3 146.38 28.55 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -82.51 114.47 20.95 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.697 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -98.34 121.17 39.94 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.43 -18.08 79.44 Favored Glycine 0 N--CA 1.452 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 113.303 -172.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -86.83 -40.4 14.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.151 0.5 . . . . 0.0 109.918 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -89.17 -11.09 44.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.581 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 60.82 41.02 15.18 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.805 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.601 HG23 HG13 ' A' ' 59' ' ' VAL . 8.8 t -155.58 152.62 29.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.757 0.313 . . . . 0.0 111.058 -176.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -83.15 106.22 14.77 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.601 HG13 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -101.46 138.04 19.79 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.53 -172.855 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.806 ' HA ' HD21 ' A' ' 49' ' ' LEU . 33.1 Cg_exo -57.83 122.72 12.23 Favored 'Trans proline' 0 CA--C 1.515 -0.448 0 C-N-CA 123.175 2.583 . . . . 0.0 112.9 -175.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -83.13 66.87 8.92 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.908 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -133.54 -67.24 0.61 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.953 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -90.32 52.54 2.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.411 0.624 . . . . 0.0 109.873 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 C--O 1.247 0.958 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.54 -177.615 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.801 0 N-CA-C 111.966 -0.453 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.33 -78.82 0.14 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.828 0.347 . . . . 0.0 110.757 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.4 ptp -128.69 -6.21 5.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.958 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.45 55.99 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.764 -0.732 . . . . 0.0 111.951 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.1 m -119.0 119.62 34.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.967 0.413 . . . . 0.0 110.295 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -117.78 -63.19 1.46 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.843 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -113.28 133.12 55.27 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.427 177.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -112.33 176.9 4.83 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.572 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 20.6 m -54.38 128.67 59.93 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 120.982 0.42 . . . . 0.0 111.139 178.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -86.42 132.09 3.61 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 122.566 2.178 . . . . 0.0 112.622 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -94.91 128.85 41.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.257 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.522 HG22 ' CE2' ' A' ' 15' ' ' TYR . 42.4 p -81.21 -4.77 56.51 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.428 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -70.56 -26.19 63.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.095 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -94.42 12.12 28.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.844 0.354 . . . . 0.0 111.416 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.522 ' CE2' HG22 ' A' ' 12' ' ' THR . 18.2 m-30 -86.4 167.11 15.02 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -114.71 111.5 21.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.687 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -68.31 120.27 14.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.99 0.424 . . . . 0.0 110.508 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -98.42 121.61 40.57 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 176.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -84.13 -18.37 37.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.152 0.501 . . . . 0.0 111.387 -175.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -86.72 -24.45 25.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.3 t -101.64 -30.81 11.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.285 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 8.09 75.38 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.668 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.533 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 68.2 m-85 -123.76 160.76 26.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 0.0 111.048 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.425 ' HE1' ' HB3' ' A' ' 35' ' ' PRO . 72.4 m-85 -86.86 111.33 20.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.082 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -74.51 124.13 26.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.987 0.422 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.477 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 13.5 t70 -94.84 116.51 66.44 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.073 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 3.0 Cg_endo -84.65 -13.72 6.9 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.042 2.495 . . . . 0.0 111.9 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -68.66 -53.78 20.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.554 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.75 -36.75 8.17 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.642 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 105.22 40.0 2.17 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.243 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.7 mt -121.11 173.3 7.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.863 0.363 . . . . 0.0 110.646 -173.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.458 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 44.5 m-85 -115.07 125.38 53.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.405 175.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.409 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 59.6 t80 -92.44 117.01 29.49 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . 0.533 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 10.3 t70 -77.13 111.85 19.34 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.425 ' HB3' ' HE1' ' A' ' 24' ' ' TYR . 27.4 Cg_endo -67.03 -19.44 51.65 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.302 2.001 . . . . 0.0 113.38 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -89.83 -49.1 6.82 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.686 0.279 . . . . 0.0 111.104 -175.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.1 m -93.76 -17.05 23.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 111.373 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 63.46 37.38 10.66 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.942 178.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -114.56 161.22 18.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.399 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -97.33 137.75 35.85 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.332 178.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.458 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 45.8 t80 -111.36 117.79 34.07 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.917 -179.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.433 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 47.1 t-20 -79.12 113.1 16.98 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.3 t -77.08 -15.06 59.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.752 -0.203 . . . . 0.0 111.511 -174.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 tp -91.53 -43.2 9.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.973 0.415 . . . . 0.0 110.7 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 m -97.61 -13.46 21.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.3 0.572 . . . . 0.0 111.133 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 62.88 43.58 6.8 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.041 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.433 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 15.3 pt20 -122.5 166.59 14.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.014 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.43 ' HB2' ' HB2' ' A' ' 64' ' ' SER . 15.3 m-85 -108.94 141.47 40.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 110.865 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.614 HD23 ' HA ' ' A' ' 60' ' ' PRO . 14.1 mt -135.2 164.98 26.46 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.412 -172.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 42.3 p90 -140.01 145.69 38.1 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.0 t-105 -76.98 123.3 26.13 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.161 176.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.98 120.38 41.62 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.73 -10.2 86.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.294 -174.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -97.09 -43.43 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 80.5 mttt -80.2 -18.27 50.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.36 179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 58.68 48.54 11.47 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . 0.632 HG22 HG23 ' A' ' 59' ' ' VAL . 9.9 t -159.05 156.64 29.61 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.451 -175.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -85.07 108.32 17.59 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 171.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.632 HG23 HG22 ' A' ' 57' ' ' THR . 0.2 OUTLIER -102.1 143.44 26.61 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.535 -173.702 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.614 ' HA ' HD23 ' A' ' 49' ' ' LEU . 45.7 Cg_exo -56.06 130.22 39.09 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.684 2.256 . . . . 0.0 111.955 177.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.92 0.62 20.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.751 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 73.37 -36.17 0.34 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.666 0.786 . . . . 0.0 112.699 175.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -66.74 -24.71 66.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.81 0.338 . . . . 0.0 111.536 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.43 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 49.5 m . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.377 176.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.628 HG12 ' HE1' ' A' ' 51' ' ' TRP . 16.8 m -67.18 118.34 54.96 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.144 0.497 . . . . 0.0 110.805 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -71.51 131.62 19.13 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.262 1.974 . . . . 0.0 112.035 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.457 ' OD2' HG23 ' A' ' 14' ' ' THR . 9.1 p-10 -105.51 120.8 42.54 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.517 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 29.0 p -71.09 7.11 1.32 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.69 -176.082 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.1 m -86.25 -12.46 49.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 175.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.457 HG23 ' OD2' ' A' ' 11' ' ' ASP . 40.0 p -99.77 11.22 39.81 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.162 0.506 . . . . 0.0 110.521 173.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.517 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -92.95 169.34 10.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.843 -177.463 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -119.51 103.94 9.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 92.5 t80 -65.54 117.56 8.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.096 0.474 . . . . 0.0 110.638 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -93.73 105.9 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -71.6 -26.83 62.75 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.008 0.432 . . . . 0.0 111.123 -173.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -73.73 -28.3 61.64 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.854 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.1 t -100.88 -31.18 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.924 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.36 11.58 60.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.193 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -123.13 157.53 32.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.747 0.308 . . . . 0.0 110.765 -177.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.63 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.0 m-85 -87.28 116.22 25.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -74.36 128.1 34.7 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.288 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.458 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 8.9 t70 -102.51 98.9 11.72 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.696 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -13.44 24.69 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.805 2.337 . . . . 0.0 112.413 172.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -47.28 70.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.058 0.456 . . . . 0.0 110.649 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.7 m -114.38 -41.09 3.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.49 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.9 38.67 0.87 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -178.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.7 mt -123.83 176.59 6.2 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.113 0.482 . . . . 0.0 110.911 -175.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -115.16 125.31 53.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.365 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.63 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 84.3 t80 -93.52 121.15 34.63 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.288 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.76 112.64 41.69 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.602 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.8 Cg_endo -63.06 -23.56 73.66 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.731 2.287 . . . . 0.0 113.341 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -87.18 -49.49 7.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 -174.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.2 m -86.77 -20.59 27.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.119 -177.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 66.38 32.43 7.61 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.426 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -119.54 162.21 19.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.383 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -95.76 140.26 30.82 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.349 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -114.5 120.15 39.28 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.006 -176.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.46 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 48.2 t-20 -83.21 112.87 20.24 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.9 t -74.54 -13.55 60.69 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -173.285 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.9 tp -89.76 -46.45 8.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -99.19 -5.78 29.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.24 0.543 . . . . 0.0 110.976 -176.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 61.67 30.38 18.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.195 176.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.46 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 21.1 pt20 -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.795 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -113.68 140.72 48.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.831 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 60' ' ' PRO . 19.5 mt -136.11 165.06 26.58 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.478 -173.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.406 ' CE2' ' HB ' ' A' ' 59' ' ' VAL . 39.3 p90 -140.98 156.84 45.98 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 174.021 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.628 ' HE1' HG12 ' A' ' 9' ' ' VAL . 72.0 t-105 -88.99 125.6 35.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.878 0.37 . . . . 0.0 111.013 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -103.99 124.41 48.96 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.33 -20.63 79.37 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.314 -173.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -85.98 -50.93 6.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.821 0.311 . . . . 0.0 110.74 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.12 -18.65 60.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.262 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 56.86 48.7 15.5 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.407 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -156.32 169.57 24.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.497 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.83 118.62 36.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.857 178.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.682 HG12 ' HD2' ' A' ' 60' ' ' PRO . 0.9 OUTLIER -107.09 144.95 30.16 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -177.748 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.682 ' HD2' HG12 ' A' ' 59' ' ' VAL . 39.8 Cg_exo -55.16 122.4 11.63 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.631 2.221 . . . . 0.0 112.119 178.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.047 -177.038 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 110.531 -0.174 . . . . 0.0 110.531 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.672 HG12 ' HE1' ' A' ' 51' ' ' TRP . 10.0 m -64.93 115.64 22.69 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.181 0.515 . . . . 0.0 110.581 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HB2' ' OH ' ' A' ' 15' ' ' TYR . 29.2 Cg_endo -64.25 132.54 34.26 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.411 2.74 . . . . 0.0 114.056 -172.073 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -100.65 119.46 38.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.049 174.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.431 HG22 ' CE1' ' A' ' 15' ' ' TYR . 25.3 p -69.66 -10.95 60.32 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.923 0.392 . . . . 0.0 111.778 -175.279 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 t -69.46 -18.49 63.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.926 175.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.1 p -95.98 9.31 41.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.911 0.386 . . . . 0.0 110.882 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.431 ' CE1' HG22 ' A' ' 12' ' ' THR . 9.0 m-30 -91.34 164.5 13.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.191 0.519 . . . . 0.0 111.199 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -117.57 104.66 11.27 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.647 176.158 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 60.8 t80 -62.58 113.38 2.94 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.563 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -87.93 96.26 10.42 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.61 -18.28 64.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.087 0.47 . . . . 0.0 111.318 -175.56 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.8 t -86.51 -15.03 41.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.368 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -108.98 -30.57 8.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.136 0.493 . . . . 0.0 110.452 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.63 11.15 58.39 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.352 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.39 158.22 43.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.821 0.343 . . . . 0.0 110.61 -177.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 63.8 m-85 -79.31 117.76 20.6 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.938 174.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.515 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 61.8 t80 -76.8 122.04 24.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.819 0.342 . . . . 0.0 110.533 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.63 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -83.62 103.06 2.34 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.414 173.963 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.515 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 5.9 Cg_exo -78.51 -15.21 14.03 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.632 2.221 . . . . 0.0 110.972 -178.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 p -75.26 -49.26 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.704 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 m -105.83 -28.52 10.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.988 0.423 . . . . 0.0 111.914 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.42 41.25 3.47 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.677 -176.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.63 ' H ' ' HB2' ' A' ' 26' ' ' ASP . 81.9 mt -125.12 -170.89 2.25 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -175.193 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.415 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 52.1 m-85 -136.82 124.79 22.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.223 174.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -90.74 121.79 32.93 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -87.22 115.46 62.76 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.834 175.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -60.94 -24.67 79.93 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 122.616 2.211 . . . . 0.0 112.788 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -84.2 -53.22 5.66 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.06 -175.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.501 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 19.2 m -80.15 -23.0 41.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.889 0.376 . . . . 0.0 111.487 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 65.97 25.73 10.99 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.659 -175.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.501 ' HD2' ' HB3' ' A' ' 37' ' ' SER . 60.1 m-85 -114.17 167.63 10.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.142 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.43 ' O ' ' HA ' ' A' ' 48' ' ' TYR . 93.5 m-85 -101.27 144.99 29.44 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.526 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 41.0 t80 -116.91 113.72 22.84 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.045 -178.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.498 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 53.9 t-20 -75.54 104.03 5.92 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -19.61 60.97 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.892 0.377 . . . . 0.0 110.903 -174.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.6 tp -79.84 -41.7 25.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.964 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -101.72 -12.2 18.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.365 0.602 . . . . 0.0 111.113 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 62.93 63.65 0.93 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.995 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.498 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 19.6 pt20 -148.15 168.34 22.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.224 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 40' ' ' TYR . 26.8 m-85 -113.65 143.33 44.76 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.378 0.609 . . . . 0.0 111.581 -178.196 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 60' ' ' PRO . 30.2 mt -140.02 169.31 17.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.591 -172.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -142.02 144.86 33.85 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 171.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.672 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.1 t-105 -77.42 113.34 15.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.202 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.463 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 14.1 t70 -97.28 117.55 31.76 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.41 -24.88 75.93 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.163 -0.541 . . . . 0.0 112.853 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.463 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 29.9 tt0 -71.33 -47.72 54.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.334 0.588 . . . . 0.0 110.547 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 mttp -87.06 -14.95 40.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.702 -176.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 59.41 41.84 18.87 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.535 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.591 HG23 HG13 ' A' ' 59' ' ' VAL . 13.0 t -150.96 155.59 39.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.526 -177.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -87.27 105.25 17.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.591 HG13 HG23 ' A' ' 57' ' ' THR . 1.1 m -100.46 148.18 34.6 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.628 -176.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.525 ' HA ' HD23 ' A' ' 49' ' ' LEU . 31.8 Cg_exo -58.87 128.72 29.01 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.096 2.531 . . . . 0.0 112.867 -177.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.433 176.663 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.525 HG12 ' HE1' ' A' ' 51' ' ' TRP . 16.9 m -60.09 119.73 44.52 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.291 0.567 . . . . 0.0 110.827 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.411 ' HB2' ' OH ' ' A' ' 15' ' ' TYR . 73.9 Cg_endo -81.24 132.77 8.37 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.714 2.276 . . . . 0.0 112.673 -177.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -96.95 127.23 42.72 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.179 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.0 p -87.02 -7.69 57.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -174.14 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.9 m -71.01 -39.41 72.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.167 0.508 . . . . 0.0 109.878 178.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 t -84.35 8.28 16.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.202 -178.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.559 ' HE2' ' HE1' ' A' ' 40' ' ' TYR . 7.5 m-30 -80.02 161.58 25.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.226 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -104.65 104.15 13.92 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.621 -175.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -60.94 112.95 2.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.312 0.577 . . . . 0.0 111.324 -175.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -82.89 96.78 8.37 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -22.52 59.75 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.18 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.4 m -81.1 -19.39 43.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.089 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.8 t -109.92 -30.39 7.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.061 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.19 37.22 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.602 ' HB2' ' HD1' ' A' ' 32' ' ' TYR . 95.1 m-85 -136.14 161.43 35.76 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.602 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.4 m-85 -81.2 116.33 21.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 175.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -74.7 129.47 37.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.032 0.444 . . . . 0.0 110.263 177.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.42 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.9 t70 -102.83 99.36 13.48 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.206 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 56.8 Cg_endo -72.68 -11.82 26.3 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.078 2.519 . . . . 0.0 112.446 175.346 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.96 -58.18 3.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.9 m -101.1 -39.86 7.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.062 0.458 . . . . 0.0 110.349 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 114.34 40.96 0.91 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 80.6 mt -124.06 173.5 8.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.994 0.426 . . . . 0.0 111.4 -175.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.602 ' HD1' ' HB2' ' A' ' 23' ' ' TYR . 20.1 m-85 -112.69 125.31 54.16 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.227 174.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.602 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 85.4 t80 -96.71 120.11 36.42 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.566 ' HA ' ' HD2' ' A' ' 23' ' ' TYR . 21.8 t0 -84.1 114.28 53.37 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 175.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -61.76 -23.39 76.13 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -83.9 -53.27 5.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.944 0.402 . . . . 0.0 111.156 -176.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -82.62 -21.3 35.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.214 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 65.45 30.33 10.88 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.882 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.418 ' HD2' ' HB3' ' A' ' 50' ' ' TYR . 30.9 m-85 -116.23 158.78 22.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.275 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' TYR . . . . . 0.559 ' HE1' ' HE2' ' A' ' 15' ' ' TYR . 90.1 m-85 -96.09 137.65 34.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.305 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -110.53 115.83 30.3 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.047 -178.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.434 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 49.8 t-20 -78.51 110.52 13.68 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -72.25 -26.64 62.08 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.823 0.344 . . . . 0.0 111.041 -175.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.1 tp -80.63 -44.2 19.26 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.892 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.3 m -98.6 -7.36 28.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.418 0.628 . . . . 0.0 111.215 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 59.56 43.44 15.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.522 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 30.0 pt20 -124.95 162.51 24.31 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.621 -176.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -107.19 139.36 41.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.223 0.535 . . . . 0.0 110.908 178.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.621 HD23 ' HA ' ' A' ' 60' ' ' PRO . 27.0 mt -137.52 166.3 24.22 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.825 -174.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.731 ' HD1' ' HB2' ' A' ' 61' ' ' ALA . 43.2 p90 -146.85 146.92 30.37 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.525 ' HE1' HG12 ' A' ' 9' ' ' VAL . 59.5 t-105 -80.26 116.48 20.37 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.372 -179.04 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.507 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 12.5 t70 -100.56 113.13 25.7 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 172.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.77 -23.62 69.23 Favored Glycine 0 N--CA 1.453 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.543 -173.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -75.73 -48.32 22.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.036 0.446 . . . . 0.0 110.078 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.507 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 26.1 mmmt -79.26 -18.22 53.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.059 -176.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 61.9 38.64 14.36 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.441 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.485 HG23 HG13 ' A' ' 59' ' ' VAL . 7.4 t -149.76 162.36 40.41 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.528 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -92.62 108.78 20.24 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.485 HG13 HG23 ' A' ' 57' ' ' THR . 3.7 m -103.26 140.0 20.65 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.837 -173.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.621 ' HA ' HD23 ' A' ' 49' ' ' LEU . 52.9 Cg_exo -56.27 122.97 12.73 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.338 2.692 . . . . 0.0 112.778 -176.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.731 ' HB2' ' HD1' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.577 -177.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.8 m -54.84 119.16 20.08 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.372 0.606 . . . . 0.0 109.983 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.46 132.55 12.39 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.678 2.252 . . . . 0.0 113.402 -170.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -81.29 133.06 35.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.279 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.436 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 12.6 p -94.65 -14.99 24.36 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.072 0.463 . . . . 0.0 110.741 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -76.0 -17.9 59.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.666 177.501 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.7 p -89.72 0.77 56.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.436 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 21.4 m-30 -85.18 158.87 20.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.551 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -100.86 103.56 14.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.745 -0.662 . . . . 0.0 109.477 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 81.7 t80 -66.82 116.68 7.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.809 0.338 . . . . 0.0 110.576 -177.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -96.01 113.44 25.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.9 -16.99 56.29 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.209 0.528 . . . . 0.0 111.522 -175.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.4 t -88.37 -19.29 26.82 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.893 -179.032 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.5 t -105.29 -30.5 9.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.305 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.02 22.71 44.2 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.3 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.419 ' HB2' ' HD2' ' A' ' 32' ' ' TYR . 86.7 m-85 -139.23 156.05 47.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.017 0.437 . . . . 0.0 111.082 -176.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.458 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 62.7 m-85 -82.07 110.85 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.918 171.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -74.66 126.84 31.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.66 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -97.95 102.21 12.98 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.07 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.57 -16.97 48.15 Favored 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 123.141 2.561 . . . . 0.0 112.801 175.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 m -69.61 -65.79 0.67 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.874 0.369 . . . . 0.0 110.809 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -33.72 15.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.413 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.88 41.53 1.96 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.291 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.518 HD22 ' HA ' ' A' ' 42' ' ' ASN . 95.7 mt -121.88 176.19 5.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.302 . . . . 0.0 110.631 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.419 ' HD2' ' HB2' ' A' ' 23' ' ' TYR . 51.1 m-85 -123.9 125.77 45.21 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.084 174.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.458 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 87.6 t80 -96.2 125.68 40.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.534 0.207 . . . . 0.0 110.448 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -89.3 117.36 68.13 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 175.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -66.99 -19.72 51.61 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.531 2.154 . . . . 0.0 112.726 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -86.57 -51.18 6.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.81 0.338 . . . . 0.0 111.148 -176.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.4 m -82.55 -19.77 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.193 0.521 . . . . 0.0 110.891 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 63.34 30.72 15.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.956 -177.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -119.55 163.86 16.69 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.999 177.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -97.42 153.12 18.31 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.433 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -124.22 121.86 36.22 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.785 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.518 ' HA ' HD22 ' A' ' 31' ' ' LEU . 45.0 t-20 -78.68 116.41 19.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 m -66.21 -25.45 66.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.822 -172.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.5 -50.49 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.828 0.347 . . . . 0.0 111.416 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.1 m -87.08 -13.94 42.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.556 0.693 . . . . 0.0 110.896 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 60.69 39.51 17.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.106 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -113.67 168.29 9.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.162 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -105.67 140.53 38.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.457 0.646 . . . . 0.0 111.233 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 60' ' ' PRO . 11.9 mt -134.94 171.22 14.71 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.312 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.448 ' CE1' HG23 ' A' ' 59' ' ' VAL . 32.6 p90 -148.01 153.79 39.42 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 173.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 59.5 t-105 -83.7 122.37 28.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.911 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -106.86 124.17 49.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 172.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -73.94 -15.01 79.82 Favored Glycine 0 N--CA 1.454 -0.157 0 C-N-CA 121.02 -0.609 . . . . 0.0 113.168 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -87.54 -47.98 8.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.703 0.287 . . . . 0.0 110.527 -177.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -81.4 -15.17 56.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.059 0.457 . . . . 0.0 110.825 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.66 41.45 15.16 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.376 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.8 t -158.6 169.39 24.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.861 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -91.92 112.27 24.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.448 HG23 ' CE1' ' A' ' 50' ' ' TYR . 2.5 m -106.56 146.84 33.84 Favored Pre-proline 0 C--N 1.318 -0.774 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.328 -176.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.68 ' HA ' HD23 ' A' ' 49' ' ' LEU . 38.8 Cg_exo -57.25 122.76 12.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.968 2.445 . . . . 0.0 113.023 -175.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.882 177.525 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.409 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 32.5 m -60.33 133.75 90.87 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.46 . . . . 0.0 110.929 178.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 24.9 Cg_endo -85.58 152.99 10.34 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.017 2.478 . . . . 0.0 112.904 -178.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.676 ' O ' ' HB ' ' A' ' 14' ' ' THR . 12.7 t70 -121.9 127.06 50.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.485 176.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.467 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 67.7 p -86.85 5.7 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -170.307 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.1 t -87.17 -23.42 24.82 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 172.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.676 ' HB ' ' O ' ' A' ' 11' ' ' ASP . 1.8 m -75.3 -17.95 60.16 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.948 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.467 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -78.07 164.06 25.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.338 -177.244 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -112.21 102.81 10.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.63 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.516 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . 89.6 t80 -72.57 128.19 34.83 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.838 0.351 . . . . 0.0 111.697 -174.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -108.55 130.36 55.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.172 172.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.0 -24.09 30.7 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.218 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -24.73 56.48 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.37 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.6 t -111.8 -30.27 7.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.408 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.12 23.96 46.45 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.541 -0.838 . . . . 0.0 111.934 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -125.75 155.5 40.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.896 0.379 . . . . 0.0 110.441 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.636 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 70.6 m-85 -88.24 114.06 24.48 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.428 169.285 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -73.84 132.97 43.1 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.932 0.396 . . . . 0.0 110.369 -177.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 19.0 t70 -104.1 97.78 12.28 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.606 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 56.4 Cg_endo -72.26 -12.89 28.03 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.875 2.384 . . . . 0.0 112.057 173.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -51.9 65.0 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.768 -178.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.6 m -117.19 -41.14 3.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.933 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.21 38.57 0.55 Allowed Glycine 0 CA--C 1.509 -0.34 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -115.01 175.68 5.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.139 0.495 . . . . 0.0 111.11 -174.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.407 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 47.0 m-85 -123.33 125.22 44.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.799 171.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.619 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.8 t80 -93.06 122.94 35.94 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.602 0.239 . . . . 0.0 110.434 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -85.17 111.35 35.55 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.636 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 16.3 Cg_endo -63.98 -25.87 66.6 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.421 2.081 . . . . 0.0 113.549 -176.005 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -89.29 -43.75 10.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 0.0 111.294 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.1 m -88.22 -18.08 29.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -177.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 63.08 25.54 15.0 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.89 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -107.85 167.6 9.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 174.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.79 139.57 39.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.274 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.407 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 47.0 t80 -109.11 114.39 28.07 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.573 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.463 ' HB2' HD11 ' A' ' 49' ' ' LEU . 47.0 t-20 -73.57 113.45 10.7 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.39 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.9 t -73.06 -17.34 61.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.427 . . . . 0.0 110.971 -176.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 tp -87.94 -51.38 5.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.995 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -94.68 -14.32 24.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.364 -174.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 63.12 46.98 4.36 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.141 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.3 pt20 -129.79 163.9 25.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.927 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -99.3 139.19 35.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.581 . . . . 0.0 111.131 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 60' ' ' PRO . 15.3 mt -137.46 168.09 20.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.741 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.403 ' HD2' ' HB2' ' A' ' 61' ' ' ALA . 35.4 p90 -144.27 149.94 37.11 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -79.34 117.77 20.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.734 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.523 ' OD2' ' HG3' ' A' ' 55' ' ' LYS . 16.3 t70 -103.12 124.7 49.06 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 172.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.36 -12.02 84.72 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -80.63 -52.1 7.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.013 0.435 . . . . 0.0 109.894 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.523 ' HG3' ' OD2' ' A' ' 52' ' ' ASP . 66.1 mttm -77.33 -18.57 57.35 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.3 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 62.05 43.73 8.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.401 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -158.29 170.91 21.19 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -96.7 112.76 24.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.67 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.401 HG23 ' CE2' ' A' ' 50' ' ' TYR . 1.7 m -109.42 152.9 42.96 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.829 -177.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.525 ' HA ' HD23 ' A' ' 49' ' ' LEU . 11.9 Cg_endo -55.72 128.58 30.94 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.219 2.613 . . . . 0.0 112.663 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.416 -177.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.52 HG12 ' HE1' ' A' ' 51' ' ' TRP . 29.6 m -60.66 131.59 91.07 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.18 0.514 . . . . 0.0 111.077 -178.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -89.37 132.53 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.958 2.439 . . . . 0.0 112.951 -178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -91.96 128.07 37.66 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.466 175.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.566 ' HA ' ' CD2' ' A' ' 15' ' ' TYR . 42.8 p -84.24 -11.58 56.22 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.089 0.471 . . . . 0.0 111.432 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -73.46 -13.99 61.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.902 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.5 p -103.11 18.07 22.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.06 0.457 . . . . 0.0 111.093 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.566 ' CD2' ' HA ' ' A' ' 12' ' ' THR . 19.6 m-30 -98.72 171.72 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.657 178.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -109.34 103.49 12.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.037 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.01 118.67 6.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.169 0.509 . . . . 0.0 110.724 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -94.91 110.02 21.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.387 -0.824 . . . . 0.0 108.986 178.076 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.21 -23.75 60.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.443 -174.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.7 t -77.13 -28.16 54.18 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.181 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 m -102.06 -30.76 10.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.07 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.82 6.05 76.8 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.509 -178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.428 ' CE2' ' HB2' ' A' ' 34' ' ' ASP . 10.0 m-85 -114.25 161.38 17.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.307 -0.446 . . . . 0.0 110.19 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -89.44 115.67 27.05 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.588 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 81.6 t80 -74.78 121.86 22.42 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.763 -177.595 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.553 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.8 OUTLIER -80.02 103.44 1.72 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.975 174.333 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.588 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 2.0 Cg_endo -80.85 -19.95 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.453 2.102 . . . . 0.0 110.67 177.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -85.08 -31.65 23.25 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.598 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.6 -18.62 13.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.264 -173.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.91 30.81 58.84 Favored Glycine 0 N--CA 1.454 -0.143 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.82 HD22 ' HA ' ' A' ' 42' ' ' ASN . 71.0 mt -125.46 -175.83 3.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.367 . . . . 0.0 110.559 -173.298 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.583 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 53.3 m-85 -125.62 125.1 42.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.74 171.332 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -91.38 121.62 33.27 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.428 ' HB2' ' CE2' ' A' ' 23' ' ' TYR . 33.9 t0 -83.17 117.8 69.72 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 175.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -67.66 -18.23 48.13 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.159 1.906 . . . . 0.0 112.414 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -86.93 -53.24 5.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.938 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.646 ' HB2' ' HD1' ' A' ' 39' ' ' TYR . 68.0 p -89.08 -21.5 23.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.856 0.36 . . . . 0.0 111.525 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 68.11 23.96 7.86 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.52 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.646 ' HD1' ' HB2' ' A' ' 37' ' ' SER . 74.8 m-85 -102.32 159.32 15.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.575 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.66 139.55 33.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.12 0.486 . . . . 0.0 110.569 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.583 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 64.4 t80 -110.37 116.49 31.53 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.038 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.82 ' HA ' HD22 ' A' ' 31' ' ' LEU . 45.7 t-20 -74.85 108.44 7.59 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 m -64.1 -27.03 68.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.874 0.369 . . . . 0.0 111.511 -174.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.8 tp -78.15 -50.97 10.96 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.486 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.6 m -95.7 -8.63 34.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.343 0.592 . . . . 0.0 111.229 -172.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 61.66 40.06 13.69 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.931 0.872 . . . . 0.0 109.469 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.423 ' HG2' ' N ' ' A' ' 48' ' ' TYR . 26.9 tt0 -111.31 165.85 11.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.218 -172.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.423 ' N ' ' HG2' ' A' ' 47' ' ' GLN . 30.9 m-85 -119.41 138.92 52.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.456 0.646 . . . . 0.0 111.34 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.622 HD23 ' HA ' ' A' ' 60' ' ' PRO . 20.0 mt -135.81 174.47 10.58 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.645 -176.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.578 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 46.6 p90 -149.96 146.85 27.27 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.52 ' HE1' HG12 ' A' ' 9' ' ' VAL . 65.1 t-105 -79.7 112.94 17.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.835 0.35 . . . . 0.0 110.204 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.416 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 9.7 t70 -91.63 114.85 27.5 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.71 -14.19 82.77 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.85 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.416 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 26.6 tt0 -79.21 -48.15 14.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.397 0.618 . . . . 0.0 109.774 178.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.8 mttp -87.94 -19.08 27.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.773 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 59.47 61.92 1.89 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.593 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -164.73 164.67 21.2 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.177 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -96.86 108.04 20.65 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.272 0.558 . . . . 0.0 109.584 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -106.53 146.23 32.62 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.267 -176.672 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.622 ' HA ' HD23 ' A' ' 49' ' ' LEU . 41.8 Cg_endo -66.08 127.57 17.9 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.958 2.438 . . . . 0.0 112.551 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.571 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.052 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.426 HG12 ' HE1' ' A' ' 51' ' ' TRP . 22.7 m -51.47 123.8 23.23 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.621 0.724 . . . . 0.0 111.716 179.077 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -78.62 132.44 10.97 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.754 2.303 . . . . 0.0 112.664 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -98.05 127.98 44.31 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 173.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.4 p -79.48 -7.17 58.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -177.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 m -81.08 -23.7 38.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.656 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 10.74 17.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.976 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -93.7 162.48 13.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.849 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -107.49 112.32 25.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.581 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -69.56 125.9 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.944 0.402 . . . . 0.0 110.629 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -100.63 132.58 45.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.79 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -84.86 -33.41 22.85 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.585 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t -75.33 -28.79 59.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.261 0.553 . . . . 0.0 109.968 -174.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.3 m -107.0 -25.69 11.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.269 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.27 22.0 68.95 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.724 178.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -117.05 154.53 30.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.824 0.345 . . . . 0.0 110.555 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.801 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 73.3 m-85 -89.18 111.1 21.8 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.177 174.362 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -74.57 122.59 23.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.029 0.442 . . . . 0.0 111.004 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.438 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 5.6 t70 -94.52 111.4 53.76 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.273 175.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 2.0 Cg_endo -84.33 -11.73 8.26 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.446 2.764 . . . . 0.0 111.799 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.83 -52.59 14.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.856 -178.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 m -104.95 -38.74 6.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.267 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.38 38.28 1.51 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.423 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.1 mt -115.73 174.35 6.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 -174.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -123.13 125.83 45.88 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.819 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.801 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.3 t80 -90.41 127.16 36.12 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.908 0.385 . . . . 0.0 110.223 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 35' ' ' PRO . 44.3 t0 -88.96 106.82 14.36 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.464 178.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.575 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 24.9 Cg_endo -66.83 -21.34 50.93 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.655 2.237 . . . . 0.0 112.416 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -89.04 -43.68 10.92 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.613 -174.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.1 m -92.65 -16.47 25.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.274 -178.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 63.18 36.44 12.02 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.712 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -131.64 169.64 15.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.465 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -97.6 149.84 21.8 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.893 0.377 . . . . 0.0 110.505 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -119.12 121.15 39.12 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.599 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.531 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 46.7 t-20 -82.08 108.87 15.91 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 p -73.62 -12.78 60.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.903 0.382 . . . . 0.0 111.723 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.6 tp -90.63 -45.56 8.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.818 0.342 . . . . 0.0 111.121 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 m -99.19 -12.96 19.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.498 . . . . 0.0 111.322 -175.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 63.48 63.58 0.87 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.786 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 4.5 pt20 -146.2 162.81 37.21 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.112 -176.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -103.5 137.48 41.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.275 0.559 . . . . 0.0 110.812 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.637 HD23 ' HA ' ' A' ' 60' ' ' PRO . 16.5 mt -133.55 165.46 24.83 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.837 -171.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.619 ' HD1' ' HB2' ' A' ' 61' ' ' ALA . 37.1 p90 -143.4 150.33 38.94 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.426 ' HE1' HG12 ' A' ' 9' ' ' VAL . 56.8 t-105 -87.42 120.53 28.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.883 0.373 . . . . 0.0 110.534 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.476 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 13.0 t70 -102.02 124.02 46.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -66.42 -18.77 68.0 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 114.111 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -96.33 -41.49 8.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 117.316 0.558 . . . . 0.0 110.458 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.476 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 10.9 mmmm -73.7 -18.24 61.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -177.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 57.25 38.03 28.52 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.373 175.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.441 HG23 HG13 ' A' ' 59' ' ' VAL . 13.0 t -158.7 163.23 37.02 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.861 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -87.59 108.84 19.25 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.441 HG13 HG23 ' A' ' 57' ' ' THR . 0.2 OUTLIER -101.79 142.63 24.97 Favored Pre-proline 0 C--N 1.314 -0.973 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.265 -175.836 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.637 ' HA ' HD23 ' A' ' 49' ' ' LEU . 22.0 Cg_exo -65.07 122.49 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.863 2.376 . . . . 0.0 113.108 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.619 ' HB2' ' HD1' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.517 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.248 0 CA-C-O 120.364 0.126 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.485 HG12 ' HE1' ' A' ' 51' ' ' TRP . 15.6 m -59.7 119.74 43.21 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 111.357 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -85.0 139.37 7.25 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -101.39 124.42 47.04 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.521 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 35.1 p -75.45 -12.02 60.16 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.567 -176.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -72.16 -23.72 61.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.759 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -96.57 18.13 14.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.887 0.375 . . . . 0.0 111.804 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.521 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 16.3 m-30 -93.28 171.6 8.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.706 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -109.68 103.91 12.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.237 179.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.64 123.64 21.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.916 0.389 . . . . 0.0 110.141 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -104.54 137.5 42.31 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.287 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -83.64 -29.55 27.59 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.571 -174.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.9 m -84.99 -30.12 24.47 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.071 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.5 t -95.59 -24.92 16.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.07 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 74.53 8.49 80.87 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.992 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.468 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 58.5 m-85 -118.46 166.37 12.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.056 0.455 . . . . 0.0 110.558 -179.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.633 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 80.1 m-85 -89.53 113.12 24.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.472 172.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -74.28 129.78 38.46 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.026 0.441 . . . . 0.0 110.591 -177.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.3 t70 -100.84 99.7 10.97 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.234 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 60.2 Cg_endo -74.19 -11.63 23.12 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 123.106 2.537 . . . . 0.0 112.54 174.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.19 -46.99 66.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.928 0.394 . . . . 0.0 110.81 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 m -116.16 -41.88 3.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.668 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.28 36.83 0.68 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.555 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 96.8 mt -117.83 178.08 4.54 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.882 0.372 . . . . 0.0 110.844 -175.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -122.73 125.49 45.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.04 175.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.55 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 82.3 t80 -92.97 121.33 34.2 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.468 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 22.9 t0 -85.55 114.16 55.0 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.307 -0.406 . . . . 0.0 109.987 176.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.633 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.1 Cg_endo -62.05 -21.59 72.68 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.618 2.212 . . . . 0.0 112.634 178.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -84.93 -53.29 5.41 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.928 -176.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.474 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 19.1 m -83.18 -19.46 36.51 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 66.25 29.58 9.55 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.598 0.561 . . . . 0.0 110.696 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.474 ' HD1' ' HB3' ' A' ' 37' ' ' SER . 52.4 m-85 -120.95 163.83 17.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.721 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -98.15 141.5 31.0 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.238 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -115.57 116.18 27.71 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.83 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 46' ' ' GLN . 44.4 t-20 -74.43 119.08 18.14 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.431 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -75.95 -16.73 59.96 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.7 tp -92.78 -57.71 2.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.982 0.42 . . . . 0.0 111.093 -179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 m -87.17 -14.17 41.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.637 0.732 . . . . 0.0 110.885 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.455 ' HA ' ' O ' ' A' ' 42' ' ' ASN . 77.1 mt-30 60.02 47.84 9.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.576 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -119.32 169.36 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.627 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -109.7 138.25 46.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.502 0.668 . . . . 0.0 111.351 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.605 HD23 ' HA ' ' A' ' 60' ' ' PRO . 18.2 mt -134.99 169.55 17.24 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.319 -173.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.466 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 34.2 p90 -150.06 149.92 31.0 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.206 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.485 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.0 t-105 -83.59 119.05 24.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.81 0.338 . . . . 0.0 110.347 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.412 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 32.5 t70 -104.23 133.91 48.35 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.949 174.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.79 -11.61 85.26 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.341 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.412 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 11.2 tp10 -90.12 -49.42 6.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.168 0.508 . . . . 0.0 110.043 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -80.77 -18.09 48.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.568 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 46.38 61.99 2.5 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.438 0.637 . . . . 0.0 111.448 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.485 HG23 HG13 ' A' ' 59' ' ' VAL . 14.7 t -169.95 170.19 7.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.149 -0.932 . . . . 0.0 108.713 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -89.56 99.74 12.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.485 HG13 HG23 ' A' ' 57' ' ' THR . 3.3 m -95.7 145.55 29.75 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.458 -176.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.605 ' HA ' HD23 ' A' ' 49' ' ' LEU . 27.6 Cg_endo -62.27 122.93 11.57 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.659 2.239 . . . . 0.0 112.321 -177.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.135 179.35 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.61 0.243 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 29.9 m -63.62 137.62 97.14 Favored Pre-proline 0 C--O 1.236 0.368 0 CA-C-O 121.154 0.502 . . . . 0.0 110.844 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 76.1 Cg_endo -88.58 132.81 2.57 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.905 2.403 . . . . 0.0 113.125 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -96.1 135.27 38.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.267 173.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.46 HG22 ' CE2' ' A' ' 15' ' ' TYR . 25.7 p -87.82 -6.57 58.06 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.157 0.503 . . . . 0.0 110.92 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -81.76 -8.7 59.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.357 178.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.6 p -105.0 18.29 22.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.786 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.46 ' CE2' HG22 ' A' ' 12' ' ' THR . 21.9 m-30 -100.93 171.22 7.78 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -117.55 104.93 11.54 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -66.11 117.13 8.0 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.312 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -97.14 130.56 44.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.153 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -84.21 -23.62 30.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.873 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.0 t -73.33 -30.18 63.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.208 -178.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.9 m -107.57 -30.25 8.72 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.065 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.91 8.15 67.51 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.475 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -119.86 165.13 15.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.85 0.357 . . . . 0.0 110.725 -176.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -88.27 111.6 21.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.711 175.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.69 128.96 36.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.67 101.02 10.65 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.979 174.289 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -67.14 -17.23 50.42 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.917 2.411 . . . . 0.0 112.341 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -65.9 -58.99 4.31 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.855 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.65 -34.6 9.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.046 -177.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 37.61 1.92 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.458 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 83.2 mt -119.12 178.84 4.36 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.872 0.368 . . . . 0.0 110.588 -174.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -127.11 125.08 40.63 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.012 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -91.17 123.41 34.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.96 114.97 62.77 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.141 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -66.82 -12.67 36.93 Favored 'Trans proline' 0 C--O 1.233 0.236 0 C-N-CA 122.584 2.189 . . . . 0.0 112.209 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -87.02 -53.09 5.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.811 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.492 ' HB2' ' HD2' ' A' ' 39' ' ' TYR . 37.1 p -89.6 -20.03 24.23 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.094 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 68.9 26.53 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.291 0.636 . . . . 0.0 110.78 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' TYR . . . . . 0.504 ' HD1' ' HB3' ' A' ' 50' ' ' TYR . 63.2 m-85 -115.29 166.14 12.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.415 176.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -98.69 142.27 30.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.356 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -116.73 118.75 33.41 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.72 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.4 t-20 -79.39 114.13 18.08 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 t -74.49 -13.31 60.67 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.941 -0.303 . . . . 0.0 111.065 -174.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -87.46 -50.97 6.19 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.774 0.321 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.0 p -96.27 -13.03 23.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.634 -175.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 65.34 35.42 7.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.25 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -107.89 174.57 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.01 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -116.23 145.61 42.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.939 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.796 HD23 ' HA ' ' A' ' 60' ' ' PRO . 13.9 mt -138.54 170.19 16.44 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.322 -177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.504 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 37.6 p90 -148.3 146.38 28.55 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -82.51 114.47 20.95 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.697 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -98.34 121.17 39.94 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.43 -18.08 79.44 Favored Glycine 0 N--CA 1.452 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 113.303 -172.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -86.83 -40.4 14.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.151 0.5 . . . . 0.0 109.918 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -89.17 -11.09 44.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.581 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 60.82 41.02 15.18 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.805 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.631 HG23 HG13 ' A' ' 59' ' ' VAL . 8.8 t -155.58 152.62 29.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.757 0.313 . . . . 0.0 111.058 -176.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -83.15 106.22 14.77 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.631 HG13 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -101.46 138.04 19.79 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.53 -172.855 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.796 ' HA ' HD23 ' A' ' 49' ' ' LEU . 33.1 Cg_exo -57.83 122.72 12.23 Favored 'Trans proline' 0 CA--C 1.515 -0.448 0 C-N-CA 123.175 2.583 . . . . 0.0 112.9 -175.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.695 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.908 179.25 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.546 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.418 HG12 ' HE1' ' A' ' 51' ' ' TRP . 20.6 m -54.38 128.67 59.93 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 120.982 0.42 . . . . 0.0 111.139 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 62.9 Cg_endo -86.42 132.09 3.61 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 122.566 2.178 . . . . 0.0 112.622 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -94.91 128.85 41.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.257 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.603 HG22 ' CE2' ' A' ' 15' ' ' TYR . 42.4 p -81.21 -4.77 56.51 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.428 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -70.56 -26.19 63.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.095 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -94.42 12.12 28.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.844 0.354 . . . . 0.0 111.416 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.603 ' CE2' HG22 ' A' ' 12' ' ' THR . 18.2 m-30 -86.4 167.11 15.02 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -114.71 111.5 21.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.687 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -68.31 120.27 14.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.99 0.424 . . . . 0.0 110.508 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -98.42 121.61 40.57 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 176.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -84.13 -18.37 37.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.152 0.501 . . . . 0.0 111.387 -175.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -86.72 -24.45 25.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.3 t -101.64 -30.81 11.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.285 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 8.09 75.38 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.668 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.551 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 68.2 m-85 -123.76 160.76 26.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 0.0 111.048 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.446 ' HE1' ' HB3' ' A' ' 35' ' ' PRO . 72.4 m-85 -86.86 111.33 20.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.082 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -74.51 124.13 26.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.987 0.422 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.484 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 13.5 t70 -94.84 116.51 66.44 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.073 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 3.0 Cg_endo -84.65 -13.72 6.9 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.042 2.495 . . . . 0.0 111.9 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -68.66 -53.78 20.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.554 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.75 -36.75 8.17 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.642 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 105.22 40.0 2.17 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.243 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.7 mt -121.11 173.3 7.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.863 0.363 . . . . 0.0 110.646 -173.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.485 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 44.5 m-85 -115.07 125.38 53.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.405 175.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.433 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 59.6 t80 -92.44 117.01 29.49 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . 0.551 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 10.3 t70 -77.13 111.85 19.34 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.446 ' HB3' ' HE1' ' A' ' 24' ' ' TYR . 27.4 Cg_endo -67.03 -19.44 51.65 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.302 2.001 . . . . 0.0 113.38 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -89.83 -49.1 6.82 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.686 0.279 . . . . 0.0 111.104 -175.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.1 m -93.76 -17.05 23.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 111.373 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 63.46 37.38 10.66 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.942 178.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -114.56 161.22 18.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.399 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -97.33 137.75 35.85 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.332 178.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TYR . . . . . 0.485 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 45.8 t80 -111.36 117.79 34.07 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.917 -179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.465 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 47.1 t-20 -79.12 113.1 16.98 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.3 t -77.08 -15.06 59.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.752 -0.203 . . . . 0.0 111.511 -174.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 tp -91.53 -43.2 9.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.973 0.415 . . . . 0.0 110.7 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 m -97.61 -13.46 21.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.3 0.572 . . . . 0.0 111.133 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 62.88 43.58 6.8 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.041 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.465 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 15.3 pt20 -122.5 166.59 14.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.014 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -108.94 141.47 40.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 110.865 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.598 HD23 ' HA ' ' A' ' 60' ' ' PRO . 14.1 mt -135.2 164.98 26.46 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.412 -172.565 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 42.3 p90 -140.01 145.69 38.1 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TRP . . . . . 0.418 ' HE1' HG12 ' A' ' 9' ' ' VAL . 70.0 t-105 -76.98 123.3 26.13 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.161 176.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.98 120.38 41.62 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.73 -10.2 86.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.294 -174.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -97.09 -43.43 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.407 ' HD2' HG21 ' A' ' 59' ' ' VAL . 80.5 mttt -80.2 -18.27 50.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.36 179.096 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 58.68 48.54 11.47 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . 0.649 HG23 HG22 ' A' ' 59' ' ' VAL . 9.9 t -159.05 156.64 29.61 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.451 -175.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -85.07 108.32 17.59 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 171.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.649 HG22 HG23 ' A' ' 57' ' ' THR . 0.2 OUTLIER -102.1 143.44 26.61 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.535 -173.702 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' PRO . . . . . 0.633 ' HD2' HG12 ' A' ' 59' ' ' VAL . 45.7 Cg_exo -56.06 130.22 39.09 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.684 2.256 . . . . 0.0 111.955 177.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.751 -176.688 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.641 0 N-CA-C 112.285 -0.326 . . . . 0.0 112.285 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 70.42 -62.17 0.44 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.531 0.732 . . . . 0.0 111.793 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.2 mmt -93.38 47.26 1.24 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.958 0.408 . . . . 0.0 110.77 -176.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.85 53.46 0.21 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.056 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.0 p -69.21 97.72 0.95 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.048 0.452 . . . . 0.0 111.24 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -95.79 -43.7 7.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.236 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.737 ' HB3' ' HH2' ' A' ' 51' ' ' TRP . 69.8 m-85 -131.5 97.83 4.34 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.574 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.72 174.72 7.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.344 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.628 HG12 ' HE1' ' A' ' 51' ' ' TRP . 16.8 m -67.18 118.34 54.96 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.144 0.497 . . . . 0.0 110.805 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -71.51 131.62 19.13 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.262 1.974 . . . . 0.0 112.035 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.457 ' OD2' HG23 ' A' ' 14' ' ' THR . 9.1 p-10 -105.51 120.8 42.54 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.517 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 29.0 p -71.09 7.11 1.32 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.69 -176.082 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.1 m -86.25 -12.46 49.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 175.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.457 HG23 ' OD2' ' A' ' 11' ' ' ASP . 40.0 p -99.77 11.22 39.81 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.162 0.506 . . . . 0.0 110.521 173.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.517 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -92.95 169.34 10.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.843 -177.463 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -119.51 103.94 9.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 92.5 t80 -65.54 117.56 8.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.096 0.474 . . . . 0.0 110.638 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -93.73 105.9 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -71.6 -26.83 62.75 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.008 0.432 . . . . 0.0 111.123 -173.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -73.73 -28.3 61.64 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.854 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.1 t -100.88 -31.18 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.924 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.36 11.58 60.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.193 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -123.13 157.53 32.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.747 0.308 . . . . 0.0 110.765 -177.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.63 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.0 m-85 -87.28 116.22 25.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -74.36 128.1 34.7 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.288 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 8.9 t70 -102.51 98.9 11.72 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.696 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -13.44 24.69 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.805 2.337 . . . . 0.0 112.413 172.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -47.28 70.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.058 0.456 . . . . 0.0 110.649 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.7 m -114.38 -41.09 3.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.49 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.9 38.67 0.87 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -178.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.7 mt -123.83 176.59 6.2 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.113 0.482 . . . . 0.0 110.911 -175.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -115.16 125.31 53.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.365 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.63 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 84.3 t80 -93.52 121.15 34.63 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.288 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.76 112.64 41.69 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.602 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.8 Cg_endo -63.06 -23.56 73.66 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.731 2.287 . . . . 0.0 113.341 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -87.18 -49.49 7.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 -174.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.2 m -86.77 -20.59 27.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.119 -177.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 66.38 32.43 7.61 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.426 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -119.54 162.21 19.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.383 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -95.76 140.26 30.82 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.349 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -114.5 120.15 39.28 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.006 -176.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.46 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 48.2 t-20 -83.21 112.87 20.24 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.9 t -74.54 -13.55 60.69 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -173.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.9 tp -89.76 -46.45 8.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -99.19 -5.78 29.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.24 0.543 . . . . 0.0 110.976 -176.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 86.6 mt-30 61.67 30.38 18.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.195 176.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.46 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 21.1 pt20 -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.795 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -113.68 140.72 48.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.831 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 60' ' ' PRO . 19.5 mt -136.11 165.06 26.58 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.478 -173.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.406 ' CE2' ' HB ' ' A' ' 59' ' ' VAL . 39.3 p90 -140.98 156.84 45.98 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 174.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.737 ' HH2' ' HB3' ' A' ' 7' ' ' TYR . 72.0 t-105 -88.99 125.6 35.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.878 0.37 . . . . 0.0 111.013 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -103.99 124.41 48.96 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.33 -20.63 79.37 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.314 -173.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -85.98 -50.93 6.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.821 0.311 . . . . 0.0 110.74 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.12 -18.65 60.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.262 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 56.86 48.7 15.5 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.407 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -156.32 169.57 24.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.497 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.83 118.62 36.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.857 178.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.682 HG12 ' HD2' ' A' ' 60' ' ' PRO . 0.9 OUTLIER -107.09 144.95 30.16 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -177.748 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.682 ' HD2' HG12 ' A' ' 59' ' ' VAL . 39.8 Cg_exo -55.16 122.4 11.63 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.631 2.221 . . . . 0.0 112.119 178.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.55 -29.89 63.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.047 -177.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -75.65 87.8 2.74 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.11 91.04 0.07 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.277 -175.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 C--O 1.251 1.166 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.279 179.862 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.81 -50.96 0.21 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.889 0.376 . . . . 0.0 110.808 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 86.1 mtp -110.29 99.17 8.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.338 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 145.59 168.1 12.89 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.0 p -83.51 -173.11 4.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.739 0.269 . . . . 0.0 110.581 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -63.12 -54.07 43.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.155 0.502 . . . . 0.0 109.858 176.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -133.94 101.26 5.0 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.456 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.58 179.54 5.35 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.531 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.672 HG12 ' HE1' ' A' ' 51' ' ' TRP . 10.0 m -64.93 115.64 22.69 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.181 0.515 . . . . 0.0 110.581 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HB2' ' OH ' ' A' ' 15' ' ' TYR . 29.2 Cg_endo -64.25 132.54 34.26 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.411 2.74 . . . . 0.0 114.056 -172.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -100.65 119.46 38.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.049 174.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.431 HG22 ' CE1' ' A' ' 15' ' ' TYR . 25.3 p -69.66 -10.95 60.32 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.923 0.392 . . . . 0.0 111.778 -175.279 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 t -69.46 -18.49 63.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.926 175.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.1 p -95.98 9.31 41.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.911 0.386 . . . . 0.0 110.882 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.431 ' CE1' HG22 ' A' ' 12' ' ' THR . 9.0 m-30 -91.34 164.5 13.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.191 0.519 . . . . 0.0 111.199 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -117.57 104.66 11.27 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.647 176.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 60.8 t80 -62.58 113.38 2.94 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.563 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -87.93 96.26 10.42 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.61 -18.28 64.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.087 0.47 . . . . 0.0 111.318 -175.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.8 t -86.51 -15.03 41.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.368 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -108.98 -30.57 8.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.136 0.493 . . . . 0.0 110.452 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.63 11.15 58.39 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.352 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.39 158.22 43.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.821 0.343 . . . . 0.0 110.61 -177.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 63.8 m-85 -79.31 117.76 20.6 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.938 174.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.515 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 61.8 t80 -76.8 122.04 24.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.819 0.342 . . . . 0.0 110.533 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.63 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -83.62 103.06 2.34 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.414 173.963 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.515 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 5.9 Cg_exo -78.51 -15.21 14.03 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.632 2.221 . . . . 0.0 110.972 -178.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 p -75.26 -49.26 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.704 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 m -105.83 -28.52 10.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.988 0.423 . . . . 0.0 111.914 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.42 41.25 3.47 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.677 -176.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.63 ' H ' ' HB2' ' A' ' 26' ' ' ASP . 81.9 mt -125.12 -170.89 2.25 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -175.193 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.415 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 52.1 m-85 -136.82 124.79 22.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.223 174.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -90.74 121.79 32.93 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -87.22 115.46 62.76 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.834 175.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -60.94 -24.67 79.93 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 122.616 2.211 . . . . 0.0 112.788 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -84.2 -53.22 5.66 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.06 -175.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.501 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 19.2 m -80.15 -23.0 41.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.889 0.376 . . . . 0.0 111.487 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 65.97 25.73 10.99 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.659 -175.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.501 ' HD2' ' HB3' ' A' ' 37' ' ' SER . 60.1 m-85 -114.17 167.63 10.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.142 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.43 ' O ' ' HA ' ' A' ' 48' ' ' TYR . 93.5 m-85 -101.27 144.99 29.44 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.526 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 41.0 t80 -116.91 113.72 22.84 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.045 -178.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.498 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 53.9 t-20 -75.54 104.03 5.92 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -19.61 60.97 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.892 0.377 . . . . 0.0 110.903 -174.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.6 tp -79.84 -41.7 25.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.964 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -101.72 -12.2 18.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.365 0.602 . . . . 0.0 111.113 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 62.93 63.65 0.93 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.995 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.498 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 19.6 pt20 -148.15 168.34 22.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.224 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 40' ' ' TYR . 26.8 m-85 -113.65 143.33 44.76 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.378 0.609 . . . . 0.0 111.581 -178.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 60' ' ' PRO . 30.2 mt -140.02 169.31 17.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.591 -172.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -142.02 144.86 33.85 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 171.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.672 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.1 t-105 -77.42 113.34 15.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.202 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.463 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 14.1 t70 -97.28 117.55 31.76 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.41 -24.88 75.93 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.163 -0.541 . . . . 0.0 112.853 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.463 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 29.9 tt0 -71.33 -47.72 54.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.334 0.588 . . . . 0.0 110.547 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 mttp -87.06 -14.95 40.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.702 -176.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 59.41 41.84 18.87 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.535 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.591 HG23 HG13 ' A' ' 59' ' ' VAL . 13.0 t -150.96 155.59 39.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.526 -177.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -87.27 105.25 17.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.591 HG13 HG23 ' A' ' 57' ' ' THR . 1.1 m -100.46 148.18 34.6 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.628 -176.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.525 ' HA ' HD23 ' A' ' 49' ' ' LEU . 31.8 Cg_exo -58.87 128.72 29.01 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.096 2.531 . . . . 0.0 112.867 -177.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.97 -7.71 57.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.433 176.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.28 90.23 7.86 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.294 177.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -84.86 -13.8 49.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.443 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.247 0.929 0 CA-C-O 118.598 -0.715 . . . . 0.0 110.216 177.86 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 71.9 139.57 0.05 Allowed 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.243 0.617 . . . . 0.0 111.638 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 87.9 mtp 65.61 26.25 11.6 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.805 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.67 -91.14 1.31 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.287 179.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.54 90.75 3.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.468 0.652 . . . . 0.0 110.736 178.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' A' ' 6' ' ' LYS . 31.9 mtmm -98.54 -49.22 4.71 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.779 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -131.94 108.25 9.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.366 177.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -104.97 -169.26 1.58 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.175 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.525 HG12 ' HE1' ' A' ' 51' ' ' TRP . 16.9 m -60.09 119.73 44.52 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.291 0.567 . . . . 0.0 110.827 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.411 ' HB2' ' OH ' ' A' ' 15' ' ' TYR . 73.9 Cg_endo -81.24 132.77 8.37 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.714 2.276 . . . . 0.0 112.673 -177.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -96.95 127.23 42.72 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.179 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.0 p -87.02 -7.69 57.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -174.14 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.9 m -71.01 -39.41 72.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.167 0.508 . . . . 0.0 109.878 178.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 t -84.35 8.28 16.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.202 -178.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.559 ' HE2' ' HE1' ' A' ' 40' ' ' TYR . 7.5 m-30 -80.02 161.58 25.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.226 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -104.65 104.15 13.92 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.621 -175.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -60.94 112.95 2.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.312 0.577 . . . . 0.0 111.324 -175.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -82.89 96.78 8.37 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -22.52 59.75 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.18 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.4 m -81.1 -19.39 43.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.089 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.8 t -109.92 -30.39 7.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.061 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.19 37.22 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.602 ' HB2' ' HD1' ' A' ' 32' ' ' TYR . 95.1 m-85 -136.14 161.43 35.76 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.602 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.4 m-85 -81.2 116.33 21.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 175.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -74.7 129.47 37.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.032 0.444 . . . . 0.0 110.263 177.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.42 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.9 t70 -102.83 99.36 13.48 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.206 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 56.8 Cg_endo -72.68 -11.82 26.3 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.078 2.519 . . . . 0.0 112.446 175.346 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.96 -58.18 3.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.9 m -101.1 -39.86 7.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.062 0.458 . . . . 0.0 110.349 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 114.34 40.96 0.91 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 80.6 mt -124.06 173.5 8.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.994 0.426 . . . . 0.0 111.4 -175.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.602 ' HD1' ' HB2' ' A' ' 23' ' ' TYR . 20.1 m-85 -112.69 125.31 54.16 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.227 174.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.602 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 85.4 t80 -96.71 120.11 36.42 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.566 ' HA ' ' HD2' ' A' ' 23' ' ' TYR . 21.8 t0 -84.1 114.28 53.37 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 175.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -61.76 -23.39 76.13 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -83.9 -53.27 5.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.944 0.402 . . . . 0.0 111.156 -176.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -82.62 -21.3 35.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.214 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 65.45 30.33 10.88 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.882 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.418 ' HD2' ' HB3' ' A' ' 50' ' ' TYR . 30.9 m-85 -116.23 158.78 22.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.275 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' TYR . . . . . 0.559 ' HE1' ' HE2' ' A' ' 15' ' ' TYR . 90.1 m-85 -96.09 137.65 34.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.305 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -110.53 115.83 30.3 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.047 -178.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.434 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 49.8 t-20 -78.51 110.52 13.68 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -72.25 -26.64 62.08 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.823 0.344 . . . . 0.0 111.041 -175.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.1 tp -80.63 -44.2 19.26 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.892 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.3 m -98.6 -7.36 28.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.418 0.628 . . . . 0.0 111.215 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 59.56 43.44 15.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.522 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 30.0 pt20 -124.95 162.51 24.31 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.621 -176.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -107.19 139.36 41.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.223 0.535 . . . . 0.0 110.908 178.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.621 HD23 ' HA ' ' A' ' 60' ' ' PRO . 27.0 mt -137.52 166.3 24.22 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.825 -174.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.731 ' HD1' ' HB2' ' A' ' 61' ' ' ALA . 43.2 p90 -146.85 146.92 30.37 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.525 ' HE1' HG12 ' A' ' 9' ' ' VAL . 59.5 t-105 -80.26 116.48 20.37 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.372 -179.04 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.507 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 12.5 t70 -100.56 113.13 25.7 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 172.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.77 -23.62 69.23 Favored Glycine 0 N--CA 1.453 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.543 -173.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -75.73 -48.32 22.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.036 0.446 . . . . 0.0 110.078 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.507 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 26.1 mmmt -79.26 -18.22 53.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.059 -176.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 61.9 38.64 14.36 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.441 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.485 HG23 HG13 ' A' ' 59' ' ' VAL . 7.4 t -149.76 162.36 40.41 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.528 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -92.62 108.78 20.24 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.485 HG13 HG23 ' A' ' 57' ' ' THR . 3.7 m -103.26 140.0 20.65 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.837 -173.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.621 ' HA ' HD23 ' A' ' 49' ' ' LEU . 52.9 Cg_exo -56.27 122.97 12.73 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.338 2.692 . . . . 0.0 112.778 -176.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.731 ' HB2' ' HD1' ' A' ' 50' ' ' TYR . . . -99.73 -2.8 34.36 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.577 -177.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -146.68 42.9 1.17 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.741 0.305 . . . . 0.0 111.357 -178.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -75.65 -17.97 59.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.077 0.465 . . . . 0.0 110.16 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.7 m . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.604 176.857 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.26 53.03 10.56 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.096 0.474 . . . . 0.0 111.344 179.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.2 ptm -137.45 18.19 2.92 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.901 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.74 52.39 3.55 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.602 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.9 m -79.75 125.17 29.33 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 121.125 0.488 . . . . 0.0 110.826 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -102.84 -41.26 6.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.672 0.749 . . . . 0.0 109.503 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -113.32 128.56 56.5 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.626 -178.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.01 -173.63 2.35 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.8 m -54.84 119.16 20.08 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.372 0.606 . . . . 0.0 109.983 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.46 132.55 12.39 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.678 2.252 . . . . 0.0 113.402 -170.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -81.29 133.06 35.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.279 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.436 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 12.6 p -94.65 -14.99 24.36 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.072 0.463 . . . . 0.0 110.741 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -76.0 -17.9 59.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.666 177.501 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.7 p -89.72 0.77 56.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.436 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 21.4 m-30 -85.18 158.87 20.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.551 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -100.86 103.56 14.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.745 -0.662 . . . . 0.0 109.477 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 81.7 t80 -66.82 116.68 7.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.809 0.338 . . . . 0.0 110.576 -177.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -96.01 113.44 25.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.9 -16.99 56.29 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.209 0.528 . . . . 0.0 111.522 -175.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.4 t -88.37 -19.29 26.82 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.893 -179.032 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.5 t -105.29 -30.5 9.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.305 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.02 22.71 44.2 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.3 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.419 ' HB2' ' HD2' ' A' ' 32' ' ' TYR . 86.7 m-85 -139.23 156.05 47.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.017 0.437 . . . . 0.0 111.082 -176.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.458 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 62.7 m-85 -82.07 110.85 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.918 171.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -74.66 126.84 31.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.66 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -97.95 102.21 12.98 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.07 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.57 -16.97 48.15 Favored 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 123.141 2.561 . . . . 0.0 112.801 175.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 m -69.61 -65.79 0.67 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.874 0.369 . . . . 0.0 110.809 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -33.72 15.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.413 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.88 41.53 1.96 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.291 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.518 HD22 ' HA ' ' A' ' 42' ' ' ASN . 95.7 mt -121.88 176.19 5.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.302 . . . . 0.0 110.631 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.419 ' HD2' ' HB2' ' A' ' 23' ' ' TYR . 51.1 m-85 -123.9 125.77 45.21 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.084 174.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.458 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 87.6 t80 -96.2 125.68 40.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.534 0.207 . . . . 0.0 110.448 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -89.3 117.36 68.13 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 175.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -66.99 -19.72 51.61 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.531 2.154 . . . . 0.0 112.726 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -86.57 -51.18 6.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.81 0.338 . . . . 0.0 111.148 -176.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.4 m -82.55 -19.77 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.193 0.521 . . . . 0.0 110.891 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 63.34 30.72 15.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.956 -177.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -119.55 163.86 16.69 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.999 177.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -97.42 153.12 18.31 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.433 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -124.22 121.86 36.22 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.785 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.518 ' HA ' HD22 ' A' ' 31' ' ' LEU . 45.0 t-20 -78.68 116.41 19.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 m -66.21 -25.45 66.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.822 -172.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.5 -50.49 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.828 0.347 . . . . 0.0 111.416 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.1 m -87.08 -13.94 42.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.556 0.693 . . . . 0.0 110.896 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 60.69 39.51 17.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.106 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -113.67 168.29 9.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.162 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -105.67 140.53 38.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.457 0.646 . . . . 0.0 111.233 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 60' ' ' PRO . 11.9 mt -134.94 171.22 14.71 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.312 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.448 ' CE1' HG23 ' A' ' 59' ' ' VAL . 32.6 p90 -148.01 153.79 39.42 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 173.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 59.5 t-105 -83.7 122.37 28.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.911 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -106.86 124.17 49.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 172.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -73.94 -15.01 79.82 Favored Glycine 0 N--CA 1.454 -0.157 0 C-N-CA 121.02 -0.609 . . . . 0.0 113.168 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -87.54 -47.98 8.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.703 0.287 . . . . 0.0 110.527 -177.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -81.4 -15.17 56.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.059 0.457 . . . . 0.0 110.825 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.66 41.45 15.16 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.376 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.8 t -158.6 169.39 24.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.861 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -91.92 112.27 24.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.448 HG23 ' CE1' ' A' ' 50' ' ' TYR . 2.5 m -106.56 146.84 33.84 Favored Pre-proline 0 C--N 1.318 -0.774 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.328 -176.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.68 ' HA ' HD23 ' A' ' 49' ' ' LEU . 38.8 Cg_exo -57.25 122.76 12.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.968 2.445 . . . . 0.0 113.023 -175.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -79.52 -12.79 59.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.882 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -107.49 31.66 5.26 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.262 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.5 112.94 13.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.736 177.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.462 -0.78 . . . . 0.0 110.189 178.907 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.27 7.52 46.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.819 0.342 . . . . 0.0 111.178 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 66.5 mtt -85.8 68.5 10.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.159 0.504 . . . . 0.0 110.343 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -149.55 29.78 1.17 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.968 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.8 m -72.76 129.63 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.4 mttp -128.52 -74.46 0.57 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.177 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -94.61 131.51 40.3 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.437 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -128.16 176.54 7.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.978 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.409 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 32.5 m -60.33 133.75 90.87 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.46 . . . . 0.0 110.929 178.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 24.9 Cg_endo -85.58 152.99 10.34 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.017 2.478 . . . . 0.0 112.904 -178.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.676 ' O ' ' HB ' ' A' ' 14' ' ' THR . 12.7 t70 -121.9 127.06 50.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.485 176.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.467 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 67.7 p -86.85 5.7 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -170.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.1 t -87.17 -23.42 24.82 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 172.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.676 ' HB ' ' O ' ' A' ' 11' ' ' ASP . 1.8 m -75.3 -17.95 60.16 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.948 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.467 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -78.07 164.06 25.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.338 -177.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -112.21 102.81 10.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.63 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.516 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . 89.6 t80 -72.57 128.19 34.83 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.838 0.351 . . . . 0.0 111.697 -174.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -108.55 130.36 55.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.172 172.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.0 -24.09 30.7 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.218 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -24.73 56.48 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.37 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.6 t -111.8 -30.27 7.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.408 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.12 23.96 46.45 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.541 -0.838 . . . . 0.0 111.934 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -125.75 155.5 40.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.896 0.379 . . . . 0.0 110.441 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.636 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 70.6 m-85 -88.24 114.06 24.48 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.428 169.285 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -73.84 132.97 43.1 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.932 0.396 . . . . 0.0 110.369 -177.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 19.0 t70 -104.1 97.78 12.28 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.606 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 56.4 Cg_endo -72.26 -12.89 28.03 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.875 2.384 . . . . 0.0 112.057 173.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -51.9 65.0 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.768 -178.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.6 m -117.19 -41.14 3.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.933 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.21 38.57 0.55 Allowed Glycine 0 CA--C 1.509 -0.34 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -115.01 175.68 5.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.139 0.495 . . . . 0.0 111.11 -174.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.407 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 47.0 m-85 -123.33 125.22 44.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.799 171.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.619 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.8 t80 -93.06 122.94 35.94 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.602 0.239 . . . . 0.0 110.434 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -85.17 111.35 35.55 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.636 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 16.3 Cg_endo -63.98 -25.87 66.6 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.421 2.081 . . . . 0.0 113.549 -176.005 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -89.29 -43.75 10.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 0.0 111.294 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.1 m -88.22 -18.08 29.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -177.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 63.08 25.54 15.0 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.89 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -107.85 167.6 9.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 174.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.79 139.57 39.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.274 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.407 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 47.0 t80 -109.11 114.39 28.07 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.573 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.463 ' HB2' HD11 ' A' ' 49' ' ' LEU . 47.0 t-20 -73.57 113.45 10.7 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.39 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.9 t -73.06 -17.34 61.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.427 . . . . 0.0 110.971 -176.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 tp -87.94 -51.38 5.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.995 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -94.68 -14.32 24.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.364 -174.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 86.8 mt-30 63.12 46.98 4.36 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.141 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 30.3 pt20 -129.79 163.9 25.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.927 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -99.3 139.19 35.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.581 . . . . 0.0 111.131 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 60' ' ' PRO . 15.3 mt -137.46 168.09 20.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.741 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.403 ' HD2' ' HB2' ' A' ' 61' ' ' ALA . 35.4 p90 -144.27 149.94 37.11 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -79.34 117.77 20.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.734 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.523 ' OD2' ' HG3' ' A' ' 55' ' ' LYS . 16.3 t70 -103.12 124.7 49.06 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 172.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.36 -12.02 84.72 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -80.63 -52.1 7.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.013 0.435 . . . . 0.0 109.894 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.523 ' HG3' ' OD2' ' A' ' 52' ' ' ASP . 66.1 mttm -77.33 -18.57 57.35 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.3 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 62.05 43.73 8.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.401 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -158.29 170.91 21.19 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -96.7 112.76 24.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.67 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.401 HG23 ' CE2' ' A' ' 50' ' ' TYR . 1.7 m -109.42 152.9 42.96 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.829 -177.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.525 ' HA ' HD23 ' A' ' 49' ' ' LEU . 11.9 Cg_endo -55.72 128.58 30.94 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.219 2.613 . . . . 0.0 112.663 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . . . -98.54 0.65 45.42 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.416 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -142.33 81.0 1.73 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.835 -179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -100.07 -36.62 9.29 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.309 -0.853 . . . . 0.0 109.895 175.745 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.631 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.41 -60.23 2.27 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.848 -0.426 . . . . 0.0 109.848 176.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 45.6 ttp 52.46 53.84 11.64 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.44 0.638 . . . . 0.0 111.161 174.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.63 29.7 2.65 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.915 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.9 p -90.22 88.01 7.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.215 0.531 . . . . 0.0 111.564 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -82.98 -37.07 24.54 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 176.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.82 101.18 4.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.249 174.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.38 -174.5 2.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.228 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.52 HG12 ' HE1' ' A' ' 51' ' ' TRP . 29.6 m -60.66 131.59 91.07 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.18 0.514 . . . . 0.0 111.077 -178.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -89.37 132.53 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.958 2.439 . . . . 0.0 112.951 -178.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -91.96 128.07 37.66 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.466 175.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.566 ' HA ' ' CD2' ' A' ' 15' ' ' TYR . 42.8 p -84.24 -11.58 56.22 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.089 0.471 . . . . 0.0 111.432 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -73.46 -13.99 61.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.902 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.5 p -103.11 18.07 22.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.06 0.457 . . . . 0.0 111.093 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.566 ' CD2' ' HA ' ' A' ' 12' ' ' THR . 19.6 m-30 -98.72 171.72 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.657 178.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -109.34 103.49 12.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.037 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.01 118.67 6.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.169 0.509 . . . . 0.0 110.724 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -94.91 110.02 21.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.387 -0.824 . . . . 0.0 108.986 178.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.21 -23.75 60.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.443 -174.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.7 t -77.13 -28.16 54.18 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.181 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 m -102.06 -30.76 10.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.07 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.82 6.05 76.8 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.509 -178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.428 ' CE2' ' HB2' ' A' ' 34' ' ' ASP . 10.0 m-85 -114.25 161.38 17.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.307 -0.446 . . . . 0.0 110.19 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -89.44 115.67 27.05 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.588 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 81.6 t80 -74.78 121.86 22.42 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.763 -177.595 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.553 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.8 OUTLIER -80.02 103.44 1.72 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.975 174.333 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.588 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 2.0 Cg_endo -80.85 -19.95 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.453 2.102 . . . . 0.0 110.67 177.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -85.08 -31.65 23.25 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.598 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.6 -18.62 13.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.264 -173.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.91 30.81 58.84 Favored Glycine 0 N--CA 1.454 -0.143 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.82 HD22 ' HA ' ' A' ' 42' ' ' ASN . 71.0 mt -125.46 -175.83 3.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.367 . . . . 0.0 110.559 -173.298 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.583 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 53.3 m-85 -125.62 125.1 42.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.74 171.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -91.38 121.62 33.27 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.428 ' HB2' ' CE2' ' A' ' 23' ' ' TYR . 33.9 t0 -83.17 117.8 69.72 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 175.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -67.66 -18.23 48.13 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.159 1.906 . . . . 0.0 112.414 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -86.93 -53.24 5.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.938 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.646 ' HB2' ' HD1' ' A' ' 39' ' ' TYR . 68.0 p -89.08 -21.5 23.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.856 0.36 . . . . 0.0 111.525 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 68.11 23.96 7.86 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.52 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.646 ' HD1' ' HB2' ' A' ' 37' ' ' SER . 74.8 m-85 -102.32 159.32 15.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.575 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.66 139.55 33.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.12 0.486 . . . . 0.0 110.569 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.583 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 64.4 t80 -110.37 116.49 31.53 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.038 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.82 ' HA ' HD22 ' A' ' 31' ' ' LEU . 45.7 t-20 -74.85 108.44 7.59 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 m -64.1 -27.03 68.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.874 0.369 . . . . 0.0 111.511 -174.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.8 tp -78.15 -50.97 10.96 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.486 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.6 m -95.7 -8.63 34.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.343 0.592 . . . . 0.0 111.229 -172.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 61.66 40.06 13.69 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.931 0.872 . . . . 0.0 109.469 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.539 ' HG3' ' HG2' ' A' ' 63' ' ' GLU . 26.9 tt0 -111.31 165.85 11.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.218 -172.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.423 ' N ' ' HG2' ' A' ' 47' ' ' GLN . 30.9 m-85 -119.41 138.92 52.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.456 0.646 . . . . 0.0 111.34 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.622 HD23 ' HA ' ' A' ' 60' ' ' PRO . 20.0 mt -135.81 174.47 10.58 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.645 -176.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.578 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 46.6 p90 -149.96 146.85 27.27 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.52 ' HE1' HG12 ' A' ' 9' ' ' VAL . 65.1 t-105 -79.7 112.94 17.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.835 0.35 . . . . 0.0 110.204 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.416 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 9.7 t70 -91.63 114.85 27.5 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.71 -14.19 82.77 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.85 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.416 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 26.6 tt0 -79.21 -48.15 14.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.397 0.618 . . . . 0.0 109.774 178.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.8 mttp -87.94 -19.08 27.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.773 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 59.47 61.92 1.89 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.593 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -164.73 164.67 21.2 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.177 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -96.86 108.04 20.65 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.272 0.558 . . . . 0.0 109.584 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -106.53 146.23 32.62 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.267 -176.672 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.622 ' HA ' HD23 ' A' ' 49' ' ' LEU . 41.8 Cg_endo -66.08 127.57 17.9 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.958 2.438 . . . . 0.0 112.551 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.571 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . . . -91.02 37.16 0.92 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.052 -178.396 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 67.77 109.8 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.989 0.806 . . . . 0.0 110.52 -175.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.539 ' HG2' ' HG3' ' A' ' 47' ' ' GLN . 33.6 mt-10 -73.12 -31.62 64.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.914 -173.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.931 175.386 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.783 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 3' ' ' MET . . . 73.24 -35.94 0.34 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.574 0.75 . . . . 0.0 112.63 178.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 2' ' ' ALA . 87.9 mmm 74.82 -32.23 0.22 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.599 0.759 . . . . 0.0 112.211 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.11 -19.34 59.28 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.12 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.44 HG23 ' HB2' ' A' ' 8' ' ' ALA . 7.8 m -86.54 74.66 9.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.745 0.783 . . . . 0.0 110.641 -178.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -96.58 -38.02 10.13 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 114.977 -1.011 . . . . 0.0 108.474 172.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -131.36 105.88 7.91 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.806 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.44 ' HB2' HG23 ' A' ' 5' ' ' THR . . . -103.23 -176.87 3.21 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.948 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.426 HG12 ' HE1' ' A' ' 51' ' ' TRP . 22.7 m -51.47 123.8 23.23 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.621 0.724 . . . . 0.0 111.716 179.077 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -78.62 132.44 10.97 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.754 2.303 . . . . 0.0 112.664 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -98.05 127.98 44.31 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 173.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.4 p -79.48 -7.17 58.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -177.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 m -81.08 -23.7 38.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.656 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 10.74 17.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.976 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -93.7 162.48 13.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.849 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -107.49 112.32 25.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.581 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -69.56 125.9 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.944 0.402 . . . . 0.0 110.629 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -100.63 132.58 45.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.79 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -84.86 -33.41 22.85 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.585 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t -75.33 -28.79 59.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.261 0.553 . . . . 0.0 109.968 -174.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.3 m -107.0 -25.69 11.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.269 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.27 22.0 68.95 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.724 178.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -117.05 154.53 30.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.824 0.345 . . . . 0.0 110.555 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.801 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 73.3 m-85 -89.18 111.1 21.8 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.177 174.362 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -74.57 122.59 23.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.029 0.442 . . . . 0.0 111.004 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.438 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 5.6 t70 -94.52 111.4 53.76 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.273 175.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 2.0 Cg_endo -84.33 -11.73 8.26 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.446 2.764 . . . . 0.0 111.799 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.83 -52.59 14.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.856 -178.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 m -104.95 -38.74 6.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.267 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.38 38.28 1.51 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.423 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.1 mt -115.73 174.35 6.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 -174.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -123.13 125.83 45.88 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.819 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.801 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.3 t80 -90.41 127.16 36.12 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.908 0.385 . . . . 0.0 110.223 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 35' ' ' PRO . 44.3 t0 -88.96 106.82 14.36 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.464 178.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.575 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 24.9 Cg_endo -66.83 -21.34 50.93 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.655 2.237 . . . . 0.0 112.416 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -89.04 -43.68 10.92 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.613 -174.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.1 m -92.65 -16.47 25.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.274 -178.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 63.18 36.44 12.02 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.712 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -131.64 169.64 15.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.465 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -97.6 149.84 21.8 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.893 0.377 . . . . 0.0 110.505 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -119.12 121.15 39.12 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.599 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.531 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 46.7 t-20 -82.08 108.87 15.91 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 p -73.62 -12.78 60.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.903 0.382 . . . . 0.0 111.723 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.6 tp -90.63 -45.56 8.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.818 0.342 . . . . 0.0 111.121 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 m -99.19 -12.96 19.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.498 . . . . 0.0 111.322 -175.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 63.48 63.58 0.87 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.786 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 4.5 pt20 -146.2 162.81 37.21 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.112 -176.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.711 ' HB2' ' HB3' ' A' ' 62' ' ' ALA . 6.9 m-85 -103.5 137.48 41.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.275 0.559 . . . . 0.0 110.812 178.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.637 HD23 ' HA ' ' A' ' 60' ' ' PRO . 16.5 mt -133.55 165.46 24.83 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.837 -171.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.619 ' HD1' ' HB2' ' A' ' 61' ' ' ALA . 37.1 p90 -143.4 150.33 38.94 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.426 ' HE1' HG12 ' A' ' 9' ' ' VAL . 56.8 t-105 -87.42 120.53 28.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.883 0.373 . . . . 0.0 110.534 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.476 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 13.0 t70 -102.02 124.02 46.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -66.42 -18.77 68.0 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 114.111 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -96.33 -41.49 8.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 117.316 0.558 . . . . 0.0 110.458 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.476 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 10.9 mmmm -73.7 -18.24 61.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -177.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 57.25 38.03 28.52 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.373 175.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.441 HG23 HG13 ' A' ' 59' ' ' VAL . 13.0 t -158.7 163.23 37.02 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.861 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -87.59 108.84 19.25 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.441 HG13 HG23 ' A' ' 57' ' ' THR . 0.2 OUTLIER -101.79 142.63 24.97 Favored Pre-proline 0 C--N 1.314 -0.973 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.265 -175.836 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.637 ' HA ' HD23 ' A' ' 49' ' ' LEU . 22.0 Cg_exo -65.07 122.49 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.863 2.376 . . . . 0.0 113.108 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.619 ' HB2' ' HD1' ' A' ' 50' ' ' TYR . . . -97.68 -35.17 10.66 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.517 178.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.711 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . . . -125.23 100.22 6.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.472 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -110.37 140.45 44.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.045 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 p . . . . . 0 C--O 1.246 0.919 0 CA-C-O 119.093 -0.479 . . . . 0.0 110.638 -179.496 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.542 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.5 -38.2 12.67 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.848 0.356 . . . . 0.0 110.351 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 49.1 ttm -67.73 -38.55 83.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.301 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.09 -104.81 2.91 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.978 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.9 t -133.93 154.5 51.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.006 0.431 . . . . 0.0 110.917 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -125.88 -159.75 0.93 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -56.05 115.25 2.32 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 171.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -127.98 178.89 5.88 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.722 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.485 HG12 ' HE1' ' A' ' 51' ' ' TRP . 15.6 m -59.7 119.74 43.21 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 111.357 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -85.0 139.37 7.25 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -101.39 124.42 47.04 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.521 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 35.1 p -75.45 -12.02 60.16 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.567 -176.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -72.16 -23.72 61.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.759 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -96.57 18.13 14.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.887 0.375 . . . . 0.0 111.804 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.521 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 16.3 m-30 -93.28 171.6 8.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.706 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -109.68 103.91 12.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.237 179.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.64 123.64 21.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.916 0.389 . . . . 0.0 110.141 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -104.54 137.5 42.31 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.287 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -83.64 -29.55 27.59 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.571 -174.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.9 m -84.99 -30.12 24.47 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.071 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.5 t -95.59 -24.92 16.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.07 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 74.53 8.49 80.87 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.992 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.468 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 58.5 m-85 -118.46 166.37 12.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.056 0.455 . . . . 0.0 110.558 -179.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.633 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 80.1 m-85 -89.53 113.12 24.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.472 172.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -74.28 129.78 38.46 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.026 0.441 . . . . 0.0 110.591 -177.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.3 t70 -100.84 99.7 10.97 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.234 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 60.2 Cg_endo -74.19 -11.63 23.12 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 123.106 2.537 . . . . 0.0 112.54 174.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.19 -46.99 66.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.928 0.394 . . . . 0.0 110.81 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 m -116.16 -41.88 3.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.668 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.28 36.83 0.68 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.555 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 96.8 mt -117.83 178.08 4.54 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.882 0.372 . . . . 0.0 110.844 -175.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -122.73 125.49 45.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.04 175.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.55 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 82.3 t80 -92.97 121.33 34.2 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.468 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 22.9 t0 -85.55 114.16 55.0 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.307 -0.406 . . . . 0.0 109.987 176.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.633 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.1 Cg_endo -62.05 -21.59 72.68 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.618 2.212 . . . . 0.0 112.634 178.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -84.93 -53.29 5.41 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.928 -176.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.474 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 19.1 m -83.18 -19.46 36.51 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 97.4 mt-30 66.25 29.58 9.55 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.598 0.561 . . . . 0.0 110.696 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.474 ' HD1' ' HB3' ' A' ' 37' ' ' SER . 52.4 m-85 -120.95 163.83 17.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.721 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -98.15 141.5 31.0 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.238 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -115.57 116.18 27.71 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.83 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 46' ' ' GLN . 44.4 t-20 -74.43 119.08 18.14 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.431 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -75.95 -16.73 59.96 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.7 tp -92.78 -57.71 2.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.982 0.42 . . . . 0.0 111.093 -179.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 m -87.17 -14.17 41.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.637 0.732 . . . . 0.0 110.885 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.455 ' HA ' ' O ' ' A' ' 42' ' ' ASN . 77.1 mt-30 60.02 47.84 9.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.576 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -119.32 169.36 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.627 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -109.7 138.25 46.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.502 0.668 . . . . 0.0 111.351 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.605 HD23 ' HA ' ' A' ' 60' ' ' PRO . 18.2 mt -134.99 169.55 17.24 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.319 -173.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.466 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 34.2 p90 -150.06 149.92 31.0 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.206 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.485 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.0 t-105 -83.59 119.05 24.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.81 0.338 . . . . 0.0 110.347 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.412 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 32.5 t70 -104.23 133.91 48.35 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.949 174.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.79 -11.61 85.26 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.341 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.412 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 11.2 tp10 -90.12 -49.42 6.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.168 0.508 . . . . 0.0 110.043 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -80.77 -18.09 48.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.568 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 46.38 61.99 2.5 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.438 0.637 . . . . 0.0 111.448 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.485 HG23 HG13 ' A' ' 59' ' ' VAL . 14.7 t -169.95 170.19 7.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.149 -0.932 . . . . 0.0 108.713 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -89.56 99.74 12.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.485 HG13 HG23 ' A' ' 57' ' ' THR . 3.3 m -95.7 145.55 29.75 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.458 -176.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.605 ' HA ' HD23 ' A' ' 49' ' ' LEU . 27.6 Cg_endo -62.27 122.93 11.57 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.659 2.239 . . . . 0.0 112.321 -177.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.18 -26.61 67.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.135 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -109.84 129.89 55.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.697 173.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -89.48 22.26 3.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.11 0.481 . . . . 0.0 110.968 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 m . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.146 177.89 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 111.861 -0.496 . . . . 0.0 111.861 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.65 50.2 2.24 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.077 0.465 . . . . 0.0 111.047 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.4 mmt -134.45 -65.93 0.62 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.15 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -169.36 85.79 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.2 p -66.19 109.52 2.66 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.26 0.552 . . . . 0.0 111.523 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -77.46 -46.65 21.89 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -136.35 110.49 8.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.192 176.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.88 178.33 4.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.062 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 29.9 m -63.62 137.62 97.14 Favored Pre-proline 0 C--O 1.236 0.368 0 CA-C-O 121.154 0.502 . . . . 0.0 110.844 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 76.1 Cg_endo -88.58 132.81 2.57 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.905 2.403 . . . . 0.0 113.125 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -96.1 135.27 38.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.267 173.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.46 HG22 ' CE2' ' A' ' 15' ' ' TYR . 25.7 p -87.82 -6.57 58.06 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.157 0.503 . . . . 0.0 110.92 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -81.76 -8.7 59.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.357 178.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.6 p -105.0 18.29 22.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.786 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.46 ' CE2' HG22 ' A' ' 12' ' ' THR . 21.9 m-30 -100.93 171.22 7.78 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -117.55 104.93 11.54 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -66.11 117.13 8.0 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.312 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -97.14 130.56 44.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.153 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -84.21 -23.62 30.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.873 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.0 t -73.33 -30.18 63.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.208 -178.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.9 m -107.57 -30.25 8.72 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.065 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.91 8.15 67.51 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.475 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -119.86 165.13 15.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.85 0.357 . . . . 0.0 110.725 -176.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -88.27 111.6 21.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.711 175.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.69 128.96 36.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.67 101.02 10.65 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.979 174.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -67.14 -17.23 50.42 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.917 2.411 . . . . 0.0 112.341 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -65.9 -58.99 4.31 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.855 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.65 -34.6 9.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.046 -177.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 37.61 1.92 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.458 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 83.2 mt -119.12 178.84 4.36 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.872 0.368 . . . . 0.0 110.588 -174.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -127.11 125.08 40.63 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.012 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -91.17 123.41 34.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.96 114.97 62.77 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.141 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -66.82 -12.67 36.93 Favored 'Trans proline' 0 C--O 1.233 0.236 0 C-N-CA 122.584 2.189 . . . . 0.0 112.209 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 47.4 t30 -87.02 -53.09 5.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.811 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.492 ' HB2' ' HD2' ' A' ' 39' ' ' TYR . 37.1 p -89.6 -20.03 24.23 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.094 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 68.9 26.53 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.291 0.636 . . . . 0.0 110.78 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' TYR . . . . . 0.504 ' HD1' ' HB3' ' A' ' 50' ' ' TYR . 63.2 m-85 -115.29 166.14 12.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.415 176.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -98.69 142.27 30.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.356 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -116.73 118.75 33.41 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.72 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.4 t-20 -79.39 114.13 18.08 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 t -74.49 -13.31 60.67 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.941 -0.303 . . . . 0.0 111.065 -174.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -87.46 -50.97 6.19 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.774 0.321 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.0 p -96.27 -13.03 23.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.634 -175.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 65.34 35.42 7.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.25 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -107.89 174.57 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.01 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -116.23 145.61 42.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.939 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.796 HD23 ' HA ' ' A' ' 60' ' ' PRO . 13.9 mt -138.54 170.19 16.44 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.322 -177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.504 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 37.6 p90 -148.3 146.38 28.55 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -82.51 114.47 20.95 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.697 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -98.34 121.17 39.94 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.43 -18.08 79.44 Favored Glycine 0 N--CA 1.452 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 113.303 -172.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -86.83 -40.4 14.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.151 0.5 . . . . 0.0 109.918 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -89.17 -11.09 44.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.581 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 60.82 41.02 15.18 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.805 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.631 HG23 HG13 ' A' ' 59' ' ' VAL . 8.8 t -155.58 152.62 29.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.757 0.313 . . . . 0.0 111.058 -176.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -83.15 106.22 14.77 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.631 HG13 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -101.46 138.04 19.79 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.53 -172.855 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.796 ' HA ' HD23 ' A' ' 49' ' ' LEU . 33.1 Cg_exo -57.83 122.72 12.23 Favored 'Trans proline' 0 CA--C 1.515 -0.448 0 C-N-CA 123.175 2.583 . . . . 0.0 112.9 -175.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -83.13 66.87 8.92 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.908 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -133.54 -67.24 0.61 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.953 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -90.32 52.54 2.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.411 0.624 . . . . 0.0 109.873 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 C--O 1.247 0.958 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.54 -177.615 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.801 0 N-CA-C 111.966 -0.453 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.33 -78.82 0.14 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.828 0.347 . . . . 0.0 110.757 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.4 ptp -128.69 -6.21 5.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.958 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.45 55.99 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.764 -0.732 . . . . 0.0 111.951 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.1 m -119.0 119.62 34.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.967 0.413 . . . . 0.0 110.295 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -117.78 -63.19 1.46 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.843 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -113.28 133.12 55.27 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.427 177.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -112.33 176.9 4.83 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.572 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.418 HG12 ' HE1' ' A' ' 51' ' ' TRP . 20.6 m -54.38 128.67 59.93 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 120.982 0.42 . . . . 0.0 111.139 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 62.9 Cg_endo -86.42 132.09 3.61 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 122.566 2.178 . . . . 0.0 112.622 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -94.91 128.85 41.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.257 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.603 HG22 ' CE2' ' A' ' 15' ' ' TYR . 42.4 p -81.21 -4.77 56.51 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.428 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -70.56 -26.19 63.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.095 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -94.42 12.12 28.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.844 0.354 . . . . 0.0 111.416 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.603 ' CE2' HG22 ' A' ' 12' ' ' THR . 18.2 m-30 -86.4 167.11 15.02 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -114.71 111.5 21.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.687 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -68.31 120.27 14.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.99 0.424 . . . . 0.0 110.508 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -98.42 121.61 40.57 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 176.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -84.13 -18.37 37.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.152 0.501 . . . . 0.0 111.387 -175.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -86.72 -24.45 25.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.3 t -101.64 -30.81 11.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.285 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 8.09 75.38 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.668 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.551 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 68.2 m-85 -123.76 160.76 26.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 0.0 111.048 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.446 ' HE1' ' HB3' ' A' ' 35' ' ' PRO . 72.4 m-85 -86.86 111.33 20.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.082 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -74.51 124.13 26.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.987 0.422 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.484 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 13.5 t70 -94.84 116.51 66.44 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.073 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 3.0 Cg_endo -84.65 -13.72 6.9 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.042 2.495 . . . . 0.0 111.9 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -68.66 -53.78 20.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.554 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.75 -36.75 8.17 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.642 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 105.22 40.0 2.17 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.243 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.7 mt -121.11 173.3 7.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.863 0.363 . . . . 0.0 110.646 -173.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.485 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 44.5 m-85 -115.07 125.38 53.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.405 175.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.433 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 59.6 t80 -92.44 117.01 29.49 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . 0.551 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 10.3 t70 -77.13 111.85 19.34 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.446 ' HB3' ' HE1' ' A' ' 24' ' ' TYR . 27.4 Cg_endo -67.03 -19.44 51.65 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.302 2.001 . . . . 0.0 113.38 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -89.83 -49.1 6.82 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.686 0.279 . . . . 0.0 111.104 -175.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.1 m -93.76 -17.05 23.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 111.373 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 63.46 37.38 10.66 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.942 178.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -114.56 161.22 18.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.399 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -97.33 137.75 35.85 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.332 178.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.485 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 45.8 t80 -111.36 117.79 34.07 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.917 -179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.465 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 47.1 t-20 -79.12 113.1 16.98 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.3 t -77.08 -15.06 59.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.752 -0.203 . . . . 0.0 111.511 -174.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 tp -91.53 -43.2 9.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.973 0.415 . . . . 0.0 110.7 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 m -97.61 -13.46 21.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.3 0.572 . . . . 0.0 111.133 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 62.88 43.58 6.8 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.041 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.465 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 15.3 pt20 -122.5 166.59 14.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.014 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.427 ' HB2' ' HB2' ' A' ' 64' ' ' SER . 15.3 m-85 -108.94 141.47 40.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 110.865 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.598 HD23 ' HA ' ' A' ' 60' ' ' PRO . 14.1 mt -135.2 164.98 26.46 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.412 -172.565 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 42.3 p90 -140.01 145.69 38.1 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TRP . . . . . 0.418 ' HE1' HG12 ' A' ' 9' ' ' VAL . 70.0 t-105 -76.98 123.3 26.13 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.161 176.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.98 120.38 41.62 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.73 -10.2 86.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.294 -174.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -97.09 -43.43 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.407 ' HD2' HG21 ' A' ' 59' ' ' VAL . 80.5 mttt -80.2 -18.27 50.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.36 179.096 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 58.68 48.54 11.47 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . 0.649 HG23 HG22 ' A' ' 59' ' ' VAL . 9.9 t -159.05 156.64 29.61 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.451 -175.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -85.07 108.32 17.59 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 171.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.649 HG22 HG23 ' A' ' 57' ' ' THR . 0.2 OUTLIER -102.1 143.44 26.61 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.535 -173.702 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.633 ' HD2' HG12 ' A' ' 59' ' ' VAL . 45.7 Cg_exo -56.06 130.22 39.09 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.684 2.256 . . . . 0.0 111.955 177.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.92 0.62 20.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.751 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 73.37 -36.17 0.34 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.666 0.786 . . . . 0.0 112.699 175.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -66.74 -24.71 66.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.81 0.338 . . . . 0.0 111.536 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.427 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 49.5 m . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.377 176.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.229 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.628 HG12 ' HE1' ' A' ' 51' ' ' TRP . 16.8 m -67.18 118.34 54.96 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.144 0.497 . . . . 0.0 110.805 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -71.51 131.62 19.13 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.262 1.974 . . . . 0.0 112.035 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.457 ' OD2' HG23 ' A' ' 14' ' ' THR . 9.1 p-10 -105.51 120.8 42.54 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.517 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 29.0 p -71.09 7.11 1.32 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.69 -176.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.1 m -86.25 -12.46 49.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 175.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.457 HG23 ' OD2' ' A' ' 11' ' ' ASP . 40.0 p -99.77 11.22 39.81 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.162 0.506 . . . . 0.0 110.521 173.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.517 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -92.95 169.34 10.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.843 -177.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -119.51 103.94 9.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 92.5 t80 -65.54 117.56 8.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.096 0.474 . . . . 0.0 110.638 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -93.73 105.9 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -71.6 -26.83 62.75 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.008 0.432 . . . . 0.0 111.123 -173.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -73.73 -28.3 61.64 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.854 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.1 t -100.88 -31.18 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.924 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.36 11.58 60.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.193 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -123.13 157.53 32.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.747 0.308 . . . . 0.0 110.765 -177.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.63 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.0 m-85 -87.28 116.22 25.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -74.36 128.1 34.7 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.288 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.458 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 8.9 t70 -102.51 98.9 11.72 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.696 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -13.44 24.69 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.805 2.337 . . . . 0.0 112.413 172.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -47.28 70.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.058 0.456 . . . . 0.0 110.649 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.7 m -114.38 -41.09 3.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.49 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.9 38.67 0.87 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -178.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.7 mt -123.83 176.59 6.2 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.113 0.482 . . . . 0.0 110.911 -175.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -115.16 125.31 53.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.365 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.63 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 84.3 t80 -93.52 121.15 34.63 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.288 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.76 112.64 41.69 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.602 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.8 Cg_endo -63.06 -23.56 73.66 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.731 2.287 . . . . 0.0 113.341 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -87.18 -49.49 7.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 -174.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.2 m -86.77 -20.59 27.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.119 -177.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 66.38 32.43 7.61 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.426 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -119.54 162.21 19.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.383 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -95.76 140.26 30.82 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.349 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -114.5 120.15 39.28 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.006 -176.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.46 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 48.2 t-20 -83.21 112.87 20.24 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.9 t -74.54 -13.55 60.69 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -173.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.9 tp -89.76 -46.45 8.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -99.19 -5.78 29.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.24 0.543 . . . . 0.0 110.976 -176.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 61.67 30.38 18.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.195 176.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.46 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 21.1 pt20 -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.795 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -113.68 140.72 48.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.831 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 60' ' ' PRO . 19.5 mt -136.11 165.06 26.58 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.478 -173.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.406 ' CE2' ' HB ' ' A' ' 59' ' ' VAL . 39.3 p90 -140.98 156.84 45.98 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 174.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.628 ' HE1' HG12 ' A' ' 9' ' ' VAL . 72.0 t-105 -88.99 125.6 35.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.878 0.37 . . . . 0.0 111.013 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -103.99 124.41 48.96 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.33 -20.63 79.37 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.314 -173.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -85.98 -50.93 6.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.821 0.311 . . . . 0.0 110.74 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.12 -18.65 60.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.262 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 56.86 48.7 15.5 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.407 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -156.32 169.57 24.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.497 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.83 118.62 36.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.857 178.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.682 HG12 ' HD2' ' A' ' 60' ' ' PRO . 0.9 OUTLIER -107.09 144.95 30.16 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -177.748 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.682 ' HD2' HG12 ' A' ' 59' ' ' VAL . 39.8 Cg_exo -55.16 122.4 11.63 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.631 2.221 . . . . 0.0 112.119 178.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.047 -177.038 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 110.531 -0.174 . . . . 0.0 110.531 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.672 HG12 ' HE1' ' A' ' 51' ' ' TRP . 10.0 m -64.93 115.64 22.69 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.181 0.515 . . . . 0.0 110.581 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HB2' ' OH ' ' A' ' 15' ' ' TYR . 29.2 Cg_endo -64.25 132.54 34.26 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.411 2.74 . . . . 0.0 114.056 -172.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -100.65 119.46 38.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.049 174.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.431 HG22 ' CE1' ' A' ' 15' ' ' TYR . 25.3 p -69.66 -10.95 60.32 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.923 0.392 . . . . 0.0 111.778 -175.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 t -69.46 -18.49 63.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.926 175.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.1 p -95.98 9.31 41.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.911 0.386 . . . . 0.0 110.882 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.431 ' CE1' HG22 ' A' ' 12' ' ' THR . 9.0 m-30 -91.34 164.5 13.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.191 0.519 . . . . 0.0 111.199 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -117.57 104.66 11.27 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.647 176.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 60.8 t80 -62.58 113.38 2.94 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.563 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -87.93 96.26 10.42 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.61 -18.28 64.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.087 0.47 . . . . 0.0 111.318 -175.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.8 t -86.51 -15.03 41.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.368 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -108.98 -30.57 8.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.136 0.493 . . . . 0.0 110.452 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.63 11.15 58.39 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.352 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.39 158.22 43.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.821 0.343 . . . . 0.0 110.61 -177.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 63.8 m-85 -79.31 117.76 20.6 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.938 174.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.515 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 61.8 t80 -76.8 122.04 24.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.819 0.342 . . . . 0.0 110.533 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.63 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -83.62 103.06 2.34 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.414 173.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.515 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 5.9 Cg_exo -78.51 -15.21 14.03 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.632 2.221 . . . . 0.0 110.972 -178.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 p -75.26 -49.26 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.704 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 m -105.83 -28.52 10.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.988 0.423 . . . . 0.0 111.914 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.42 41.25 3.47 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.677 -176.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.63 ' H ' ' HB2' ' A' ' 26' ' ' ASP . 81.9 mt -125.12 -170.89 2.25 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -175.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.415 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 52.1 m-85 -136.82 124.79 22.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.223 174.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -90.74 121.79 32.93 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -87.22 115.46 62.76 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.834 175.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -60.94 -24.67 79.93 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 122.616 2.211 . . . . 0.0 112.788 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -84.2 -53.22 5.66 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.06 -175.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.501 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 19.2 m -80.15 -23.0 41.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.889 0.376 . . . . 0.0 111.487 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 65.97 25.73 10.99 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.659 -175.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.501 ' HD2' ' HB3' ' A' ' 37' ' ' SER . 60.1 m-85 -114.17 167.63 10.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.142 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.43 ' O ' ' HA ' ' A' ' 48' ' ' TYR . 93.5 m-85 -101.27 144.99 29.44 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.526 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 41.0 t80 -116.91 113.72 22.84 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.045 -178.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.498 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 53.9 t-20 -75.54 104.03 5.92 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -19.61 60.97 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.892 0.377 . . . . 0.0 110.903 -174.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.6 tp -79.84 -41.7 25.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.964 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -101.72 -12.2 18.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.365 0.602 . . . . 0.0 111.113 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 62.93 63.65 0.93 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.995 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.498 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 19.6 pt20 -148.15 168.34 22.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.224 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 40' ' ' TYR . 26.8 m-85 -113.65 143.33 44.76 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.378 0.609 . . . . 0.0 111.581 -178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 60' ' ' PRO . 30.2 mt -140.02 169.31 17.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.591 -172.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -142.02 144.86 33.85 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 171.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.672 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.1 t-105 -77.42 113.34 15.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.202 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.463 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 14.1 t70 -97.28 117.55 31.76 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.41 -24.88 75.93 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.163 -0.541 . . . . 0.0 112.853 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.463 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 29.9 tt0 -71.33 -47.72 54.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.334 0.588 . . . . 0.0 110.547 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 mttp -87.06 -14.95 40.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.702 -176.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 59.41 41.84 18.87 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.535 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.591 HG23 HG13 ' A' ' 59' ' ' VAL . 13.0 t -150.96 155.59 39.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.526 -177.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -87.27 105.25 17.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.591 HG13 HG23 ' A' ' 57' ' ' THR . 1.1 m -100.46 148.18 34.6 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.628 -176.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.525 ' HA ' HD23 ' A' ' 49' ' ' LEU . 31.8 Cg_exo -58.87 128.72 29.01 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.096 2.531 . . . . 0.0 112.867 -177.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.433 176.663 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.339 0 N-CA-C 110.175 -0.305 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.525 HG12 ' HE1' ' A' ' 51' ' ' TRP . 16.9 m -60.09 119.73 44.52 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.291 0.567 . . . . 0.0 110.827 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.411 ' HB2' ' OH ' ' A' ' 15' ' ' TYR . 73.9 Cg_endo -81.24 132.77 8.37 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.714 2.276 . . . . 0.0 112.673 -177.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -96.95 127.23 42.72 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.179 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.0 p -87.02 -7.69 57.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -174.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.9 m -71.01 -39.41 72.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.167 0.508 . . . . 0.0 109.878 178.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 t -84.35 8.28 16.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.202 -178.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.559 ' HE2' ' HE1' ' A' ' 40' ' ' TYR . 7.5 m-30 -80.02 161.58 25.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.226 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -104.65 104.15 13.92 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.621 -175.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -60.94 112.95 2.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.312 0.577 . . . . 0.0 111.324 -175.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -82.89 96.78 8.37 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -22.52 59.75 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.18 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.4 m -81.1 -19.39 43.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.089 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.8 t -109.92 -30.39 7.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.061 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.19 37.22 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.602 ' HB2' ' HD1' ' A' ' 32' ' ' TYR . 95.1 m-85 -136.14 161.43 35.76 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.602 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.4 m-85 -81.2 116.33 21.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 175.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -74.7 129.47 37.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.032 0.444 . . . . 0.0 110.263 177.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.42 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.9 t70 -102.83 99.36 13.48 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.206 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 56.8 Cg_endo -72.68 -11.82 26.3 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.078 2.519 . . . . 0.0 112.446 175.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.96 -58.18 3.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.9 m -101.1 -39.86 7.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.062 0.458 . . . . 0.0 110.349 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 114.34 40.96 0.91 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 80.6 mt -124.06 173.5 8.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.994 0.426 . . . . 0.0 111.4 -175.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.602 ' HD1' ' HB2' ' A' ' 23' ' ' TYR . 20.1 m-85 -112.69 125.31 54.16 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.227 174.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.602 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 85.4 t80 -96.71 120.11 36.42 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.566 ' HA ' ' HD2' ' A' ' 23' ' ' TYR . 21.8 t0 -84.1 114.28 53.37 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 175.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -61.76 -23.39 76.13 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.41 HD22 ' HA ' ' A' ' 36' ' ' ASN . 3.3 t-20 -83.9 -53.27 5.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.944 0.402 . . . . 0.0 111.156 -176.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -82.62 -21.3 35.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.214 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 65.45 30.33 10.88 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.882 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.418 ' HD2' ' HB3' ' A' ' 50' ' ' TYR . 30.9 m-85 -116.23 158.78 22.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.275 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . 0.559 ' HE1' ' HE2' ' A' ' 15' ' ' TYR . 90.1 m-85 -96.09 137.65 34.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.305 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -110.53 115.83 30.3 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.047 -178.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.434 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 49.8 t-20 -78.51 110.52 13.68 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -72.25 -26.64 62.08 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.823 0.344 . . . . 0.0 111.041 -175.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.1 tp -80.63 -44.2 19.26 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.892 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.3 m -98.6 -7.36 28.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.418 0.628 . . . . 0.0 111.215 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 59.56 43.44 15.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.522 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 4.2 pt20 -124.95 162.51 24.31 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.621 -176.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -107.19 139.36 41.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.223 0.535 . . . . 0.0 110.908 178.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.621 HD23 ' HA ' ' A' ' 60' ' ' PRO . 27.0 mt -137.52 166.3 24.22 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.825 -174.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.731 ' HD1' ' HB2' ' A' ' 61' ' ' ALA . 43.2 p90 -146.85 146.92 30.37 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.525 ' HE1' HG12 ' A' ' 9' ' ' VAL . 59.5 t-105 -80.26 116.48 20.37 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.372 -179.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.507 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 12.5 t70 -100.56 113.13 25.7 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 172.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.77 -23.62 69.23 Favored Glycine 0 N--CA 1.453 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.543 -173.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -75.73 -48.32 22.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.036 0.446 . . . . 0.0 110.078 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.507 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 26.1 mmmt -79.26 -18.22 53.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.059 -176.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 61.9 38.64 14.36 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.441 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.485 HG23 HG13 ' A' ' 59' ' ' VAL . 7.4 t -149.76 162.36 40.41 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.528 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -92.62 108.78 20.24 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.485 HG13 HG23 ' A' ' 57' ' ' THR . 3.7 m -103.26 140.0 20.65 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.837 -173.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.621 ' HA ' HD23 ' A' ' 49' ' ' LEU . 52.9 Cg_exo -56.27 122.97 12.73 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.338 2.692 . . . . 0.0 112.778 -176.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.731 ' HB2' ' HD1' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.577 -177.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.8 m -54.84 119.16 20.08 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.372 0.606 . . . . 0.0 109.983 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.46 132.55 12.39 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.678 2.252 . . . . 0.0 113.402 -170.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -81.29 133.06 35.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.279 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.436 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 12.6 p -94.65 -14.99 24.36 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.072 0.463 . . . . 0.0 110.741 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -76.0 -17.9 59.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.666 177.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.7 p -89.72 0.77 56.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.436 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 21.4 m-30 -85.18 158.87 20.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.551 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -100.86 103.56 14.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.745 -0.662 . . . . 0.0 109.477 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 81.7 t80 -66.82 116.68 7.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.809 0.338 . . . . 0.0 110.576 -177.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -96.01 113.44 25.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.9 -16.99 56.29 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.209 0.528 . . . . 0.0 111.522 -175.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.4 t -88.37 -19.29 26.82 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.893 -179.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.5 t -105.29 -30.5 9.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.305 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.02 22.71 44.2 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.3 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.419 ' HB2' ' HD2' ' A' ' 32' ' ' TYR . 86.7 m-85 -139.23 156.05 47.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.017 0.437 . . . . 0.0 111.082 -176.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.458 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 62.7 m-85 -82.07 110.85 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.918 171.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -74.66 126.84 31.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.66 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -97.95 102.21 12.98 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.07 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.57 -16.97 48.15 Favored 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 123.141 2.561 . . . . 0.0 112.801 175.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 m -69.61 -65.79 0.67 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.874 0.369 . . . . 0.0 110.809 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -33.72 15.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.413 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.88 41.53 1.96 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.291 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.518 HD22 ' HA ' ' A' ' 42' ' ' ASN . 95.7 mt -121.88 176.19 5.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.302 . . . . 0.0 110.631 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.419 ' HD2' ' HB2' ' A' ' 23' ' ' TYR . 51.1 m-85 -123.9 125.77 45.21 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.084 174.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.458 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 87.6 t80 -96.2 125.68 40.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.534 0.207 . . . . 0.0 110.448 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -89.3 117.36 68.13 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 175.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -66.99 -19.72 51.61 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.531 2.154 . . . . 0.0 112.726 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -86.57 -51.18 6.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.81 0.338 . . . . 0.0 111.148 -176.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.4 m -82.55 -19.77 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.193 0.521 . . . . 0.0 110.891 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 63.34 30.72 15.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.956 -177.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -119.55 163.86 16.69 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.999 177.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -97.42 153.12 18.31 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.433 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -124.22 121.86 36.22 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.785 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.518 ' HA ' HD22 ' A' ' 31' ' ' LEU . 45.0 t-20 -78.68 116.41 19.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 m -66.21 -25.45 66.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.822 -172.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.5 -50.49 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.828 0.347 . . . . 0.0 111.416 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.1 m -87.08 -13.94 42.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.556 0.693 . . . . 0.0 110.896 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 60.69 39.51 17.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.106 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -113.67 168.29 9.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.162 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -105.67 140.53 38.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.457 0.646 . . . . 0.0 111.233 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 60' ' ' PRO . 11.9 mt -134.94 171.22 14.71 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.312 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.448 ' CE1' HG23 ' A' ' 59' ' ' VAL . 32.6 p90 -148.01 153.79 39.42 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 173.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 59.5 t-105 -83.7 122.37 28.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.911 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -106.86 124.17 49.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 172.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -73.94 -15.01 79.82 Favored Glycine 0 N--CA 1.454 -0.157 0 C-N-CA 121.02 -0.609 . . . . 0.0 113.168 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -87.54 -47.98 8.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.703 0.287 . . . . 0.0 110.527 -177.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -81.4 -15.17 56.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.059 0.457 . . . . 0.0 110.825 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.66 41.45 15.16 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.376 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.8 t -158.6 169.39 24.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.861 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -91.92 112.27 24.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.448 HG23 ' CE1' ' A' ' 50' ' ' TYR . 2.5 m -106.56 146.84 33.84 Favored Pre-proline 0 C--N 1.318 -0.774 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.328 -176.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.68 ' HA ' HD23 ' A' ' 49' ' ' LEU . 38.8 Cg_exo -57.25 122.76 12.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.968 2.445 . . . . 0.0 113.023 -175.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.882 177.525 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.409 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 32.5 m -60.33 133.75 90.87 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.46 . . . . 0.0 110.929 178.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 24.9 Cg_endo -85.58 152.99 10.34 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.017 2.478 . . . . 0.0 112.904 -178.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.676 ' O ' ' HB ' ' A' ' 14' ' ' THR . 12.7 t70 -121.9 127.06 50.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.485 176.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.467 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 67.7 p -86.85 5.7 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -170.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.1 t -87.17 -23.42 24.82 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 172.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.676 ' HB ' ' O ' ' A' ' 11' ' ' ASP . 1.8 m -75.3 -17.95 60.16 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.948 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.467 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -78.07 164.06 25.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.338 -177.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -112.21 102.81 10.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.63 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.516 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . 89.6 t80 -72.57 128.19 34.83 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.838 0.351 . . . . 0.0 111.697 -174.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -108.55 130.36 55.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.172 172.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.0 -24.09 30.7 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.218 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -24.73 56.48 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.37 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.6 t -111.8 -30.27 7.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.408 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.12 23.96 46.45 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.541 -0.838 . . . . 0.0 111.934 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -125.75 155.5 40.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.896 0.379 . . . . 0.0 110.441 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.636 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 70.6 m-85 -88.24 114.06 24.48 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.428 169.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -73.84 132.97 43.1 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.932 0.396 . . . . 0.0 110.369 -177.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 19.0 t70 -104.1 97.78 12.28 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.606 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 56.4 Cg_endo -72.26 -12.89 28.03 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.875 2.384 . . . . 0.0 112.057 173.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -51.9 65.0 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.768 -178.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.6 m -117.19 -41.14 3.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.933 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.21 38.57 0.55 Allowed Glycine 0 CA--C 1.509 -0.34 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -115.01 175.68 5.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.139 0.495 . . . . 0.0 111.11 -174.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.407 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 47.0 m-85 -123.33 125.22 44.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.799 171.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.619 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.8 t80 -93.06 122.94 35.94 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.602 0.239 . . . . 0.0 110.434 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -85.17 111.35 35.55 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.636 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 16.3 Cg_endo -63.98 -25.87 66.6 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.421 2.081 . . . . 0.0 113.549 -176.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -89.29 -43.75 10.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 0.0 111.294 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.1 m -88.22 -18.08 29.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -177.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 63.08 25.54 15.0 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.89 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -107.85 167.6 9.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 174.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.79 139.57 39.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.274 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.407 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 47.0 t80 -109.11 114.39 28.07 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.573 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.463 ' HB2' HD11 ' A' ' 49' ' ' LEU . 47.0 t-20 -73.57 113.45 10.7 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.39 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.9 t -73.06 -17.34 61.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.427 . . . . 0.0 110.971 -176.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 tp -87.94 -51.38 5.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.995 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -94.68 -14.32 24.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.364 -174.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 63.12 46.98 4.36 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.141 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -129.79 163.9 25.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.927 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -99.3 139.19 35.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.581 . . . . 0.0 111.131 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 60' ' ' PRO . 15.3 mt -137.46 168.09 20.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.741 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.403 ' HD2' ' HB2' ' A' ' 61' ' ' ALA . 35.4 p90 -144.27 149.94 37.11 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -79.34 117.77 20.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.734 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.523 ' OD2' ' HG3' ' A' ' 55' ' ' LYS . 16.3 t70 -103.12 124.7 49.06 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 172.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.36 -12.02 84.72 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -80.63 -52.1 7.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.013 0.435 . . . . 0.0 109.894 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.523 ' HG3' ' OD2' ' A' ' 52' ' ' ASP . 66.1 mttm -77.33 -18.57 57.35 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.3 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 62.05 43.73 8.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.401 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -158.29 170.91 21.19 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -96.7 112.76 24.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.67 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.401 HG23 ' CE2' ' A' ' 50' ' ' TYR . 1.7 m -109.42 152.9 42.96 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.829 -177.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.525 ' HA ' HD23 ' A' ' 49' ' ' LEU . 11.9 Cg_endo -55.72 128.58 30.94 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.219 2.613 . . . . 0.0 112.663 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.416 -177.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.296 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.52 HG12 ' HE1' ' A' ' 51' ' ' TRP . 29.6 m -60.66 131.59 91.07 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.18 0.514 . . . . 0.0 111.077 -178.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -89.37 132.53 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.958 2.439 . . . . 0.0 112.951 -178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -91.96 128.07 37.66 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.466 175.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.566 ' HA ' ' CD2' ' A' ' 15' ' ' TYR . 42.8 p -84.24 -11.58 56.22 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.089 0.471 . . . . 0.0 111.432 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -73.46 -13.99 61.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.902 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.5 p -103.11 18.07 22.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.06 0.457 . . . . 0.0 111.093 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.566 ' CD2' ' HA ' ' A' ' 12' ' ' THR . 19.6 m-30 -98.72 171.72 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.657 178.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -109.34 103.49 12.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.037 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.01 118.67 6.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.169 0.509 . . . . 0.0 110.724 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -94.91 110.02 21.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.387 -0.824 . . . . 0.0 108.986 178.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.21 -23.75 60.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.443 -174.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.7 t -77.13 -28.16 54.18 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.181 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 m -102.06 -30.76 10.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.07 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.82 6.05 76.8 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.509 -178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.428 ' CE2' ' HB2' ' A' ' 34' ' ' ASP . 10.0 m-85 -114.25 161.38 17.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.307 -0.446 . . . . 0.0 110.19 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -89.44 115.67 27.05 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.588 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 81.6 t80 -74.78 121.86 22.42 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.763 -177.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.553 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.8 OUTLIER -80.02 103.44 1.72 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.975 174.333 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.588 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 2.0 Cg_endo -80.85 -19.95 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.453 2.102 . . . . 0.0 110.67 177.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -85.08 -31.65 23.25 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.598 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.6 -18.62 13.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.264 -173.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.91 30.81 58.84 Favored Glycine 0 N--CA 1.454 -0.143 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.82 HD22 ' HA ' ' A' ' 42' ' ' ASN . 71.0 mt -125.46 -175.83 3.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.367 . . . . 0.0 110.559 -173.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.583 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 53.3 m-85 -125.62 125.1 42.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.74 171.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -91.38 121.62 33.27 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.428 ' HB2' ' CE2' ' A' ' 23' ' ' TYR . 33.9 t0 -83.17 117.8 69.72 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 175.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -67.66 -18.23 48.13 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.159 1.906 . . . . 0.0 112.414 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -86.93 -53.24 5.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.938 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.646 ' HB2' ' HD1' ' A' ' 39' ' ' TYR . 68.0 p -89.08 -21.5 23.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.856 0.36 . . . . 0.0 111.525 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 68.11 23.96 7.86 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.52 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.646 ' HD1' ' HB2' ' A' ' 37' ' ' SER . 74.8 m-85 -102.32 159.32 15.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.575 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.66 139.55 33.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.12 0.486 . . . . 0.0 110.569 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.583 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 64.4 t80 -110.37 116.49 31.53 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.038 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.82 ' HA ' HD22 ' A' ' 31' ' ' LEU . 45.7 t-20 -74.85 108.44 7.59 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 m -64.1 -27.03 68.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.874 0.369 . . . . 0.0 111.511 -174.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.8 tp -78.15 -50.97 10.96 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.486 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.6 m -95.7 -8.63 34.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.343 0.592 . . . . 0.0 111.229 -172.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 61.66 40.06 13.69 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.931 0.872 . . . . 0.0 109.469 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.423 ' HG2' ' N ' ' A' ' 48' ' ' TYR . 26.9 tt0 -111.31 165.85 11.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.218 -172.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.423 ' N ' ' HG2' ' A' ' 47' ' ' GLN . 30.9 m-85 -119.41 138.92 52.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.456 0.646 . . . . 0.0 111.34 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.622 HD23 ' HA ' ' A' ' 60' ' ' PRO . 20.0 mt -135.81 174.47 10.58 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.645 -176.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.578 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 46.6 p90 -149.96 146.85 27.27 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.52 ' HE1' HG12 ' A' ' 9' ' ' VAL . 65.1 t-105 -79.7 112.94 17.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.835 0.35 . . . . 0.0 110.204 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.416 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 9.7 t70 -91.63 114.85 27.5 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.71 -14.19 82.77 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.85 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.416 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 26.6 tt0 -79.21 -48.15 14.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.397 0.618 . . . . 0.0 109.774 178.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.8 mttp -87.94 -19.08 27.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.773 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 59.47 61.92 1.89 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.593 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -164.73 164.67 21.2 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.177 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -96.86 108.04 20.65 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.272 0.558 . . . . 0.0 109.584 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -106.53 146.23 32.62 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.267 -176.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.622 ' HA ' HD23 ' A' ' 49' ' ' LEU . 41.8 Cg_endo -66.08 127.57 17.9 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.958 2.438 . . . . 0.0 112.551 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.571 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.052 -178.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.408 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.426 HG12 ' HE1' ' A' ' 51' ' ' TRP . 22.7 m -51.47 123.8 23.23 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.621 0.724 . . . . 0.0 111.716 179.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -78.62 132.44 10.97 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.754 2.303 . . . . 0.0 112.664 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -98.05 127.98 44.31 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 173.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.4 p -79.48 -7.17 58.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -177.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 m -81.08 -23.7 38.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.656 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 10.74 17.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.976 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -93.7 162.48 13.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.849 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -107.49 112.32 25.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.581 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -69.56 125.9 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.944 0.402 . . . . 0.0 110.629 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -100.63 132.58 45.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.79 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -84.86 -33.41 22.85 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.585 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t -75.33 -28.79 59.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.261 0.553 . . . . 0.0 109.968 -174.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.3 m -107.0 -25.69 11.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.269 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.27 22.0 68.95 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.724 178.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -117.05 154.53 30.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.824 0.345 . . . . 0.0 110.555 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.801 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 73.3 m-85 -89.18 111.1 21.8 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.177 174.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -74.57 122.59 23.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.029 0.442 . . . . 0.0 111.004 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.438 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 5.6 t70 -94.52 111.4 53.76 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.273 175.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 2.0 Cg_endo -84.33 -11.73 8.26 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.446 2.764 . . . . 0.0 111.799 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.83 -52.59 14.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.856 -178.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 m -104.95 -38.74 6.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.267 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.38 38.28 1.51 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.423 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.1 mt -115.73 174.35 6.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 -174.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -123.13 125.83 45.88 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.819 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.801 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.3 t80 -90.41 127.16 36.12 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.908 0.385 . . . . 0.0 110.223 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 35' ' ' PRO . 44.3 t0 -88.96 106.82 14.36 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.464 178.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.575 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 24.9 Cg_endo -66.83 -21.34 50.93 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.655 2.237 . . . . 0.0 112.416 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -89.04 -43.68 10.92 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.613 -174.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.1 m -92.65 -16.47 25.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.274 -178.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 63.18 36.44 12.02 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.712 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -131.64 169.64 15.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.465 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -97.6 149.84 21.8 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.893 0.377 . . . . 0.0 110.505 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -119.12 121.15 39.12 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.599 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.531 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 46.7 t-20 -82.08 108.87 15.91 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 p -73.62 -12.78 60.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.903 0.382 . . . . 0.0 111.723 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.6 tp -90.63 -45.56 8.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.818 0.342 . . . . 0.0 111.121 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 m -99.19 -12.96 19.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.498 . . . . 0.0 111.322 -175.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 63.48 63.58 0.87 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.786 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 4.5 pt20 -146.2 162.81 37.21 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.112 -176.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -103.5 137.48 41.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.275 0.559 . . . . 0.0 110.812 178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.637 HD23 ' HA ' ' A' ' 60' ' ' PRO . 16.5 mt -133.55 165.46 24.83 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.837 -171.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.619 ' HD1' ' HB2' ' A' ' 61' ' ' ALA . 37.1 p90 -143.4 150.33 38.94 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.426 ' HE1' HG12 ' A' ' 9' ' ' VAL . 56.8 t-105 -87.42 120.53 28.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.883 0.373 . . . . 0.0 110.534 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.476 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 13.0 t70 -102.02 124.02 46.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -66.42 -18.77 68.0 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 114.111 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -96.33 -41.49 8.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 117.316 0.558 . . . . 0.0 110.458 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.476 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 10.9 mmmm -73.7 -18.24 61.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -177.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 57.25 38.03 28.52 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.373 175.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.441 HG23 HG13 ' A' ' 59' ' ' VAL . 13.0 t -158.7 163.23 37.02 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.861 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -87.59 108.84 19.25 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.441 HG13 HG23 ' A' ' 57' ' ' THR . 0.2 OUTLIER -101.79 142.63 24.97 Favored Pre-proline 0 C--N 1.314 -0.973 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.265 -175.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.637 ' HA ' HD23 ' A' ' 49' ' ' LEU . 22.0 Cg_exo -65.07 122.49 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.863 2.376 . . . . 0.0 113.108 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.619 ' HB2' ' HD1' ' A' ' 50' ' ' TYR . . . . . . . . 0 C--N 1.321 -0.646 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.517 178.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.248 0 CA-C-O 120.364 0.126 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.485 HG12 ' HE1' ' A' ' 51' ' ' TRP . 15.6 m -59.7 119.74 43.21 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 111.357 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -85.0 139.37 7.25 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -101.39 124.42 47.04 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.521 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 35.1 p -75.45 -12.02 60.16 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.567 -176.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -72.16 -23.72 61.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.759 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -96.57 18.13 14.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.887 0.375 . . . . 0.0 111.804 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.521 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 16.3 m-30 -93.28 171.6 8.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.706 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -109.68 103.91 12.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.237 179.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.64 123.64 21.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.916 0.389 . . . . 0.0 110.141 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -104.54 137.5 42.31 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.287 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -83.64 -29.55 27.59 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.571 -174.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.9 m -84.99 -30.12 24.47 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.071 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.5 t -95.59 -24.92 16.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.07 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 74.53 8.49 80.87 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.992 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.468 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 58.5 m-85 -118.46 166.37 12.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.056 0.455 . . . . 0.0 110.558 -179.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.633 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 80.1 m-85 -89.53 113.12 24.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.472 172.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -74.28 129.78 38.46 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.026 0.441 . . . . 0.0 110.591 -177.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.3 t70 -100.84 99.7 10.97 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.234 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 60.2 Cg_endo -74.19 -11.63 23.12 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 123.106 2.537 . . . . 0.0 112.54 174.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.19 -46.99 66.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.928 0.394 . . . . 0.0 110.81 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 m -116.16 -41.88 3.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.668 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.28 36.83 0.68 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.555 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 96.8 mt -117.83 178.08 4.54 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.882 0.372 . . . . 0.0 110.844 -175.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -122.73 125.49 45.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.04 175.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.55 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 82.3 t80 -92.97 121.33 34.2 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.468 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 22.9 t0 -85.55 114.16 55.0 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.307 -0.406 . . . . 0.0 109.987 176.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.633 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.1 Cg_endo -62.05 -21.59 72.68 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.618 2.212 . . . . 0.0 112.634 178.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -84.93 -53.29 5.41 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.928 -176.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.474 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 19.1 m -83.18 -19.46 36.51 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 66.25 29.58 9.55 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.598 0.561 . . . . 0.0 110.696 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.474 ' HD1' ' HB3' ' A' ' 37' ' ' SER . 52.4 m-85 -120.95 163.83 17.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.721 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -98.15 141.5 31.0 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.238 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -115.57 116.18 27.71 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.83 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 46' ' ' GLN . 44.4 t-20 -74.43 119.08 18.14 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -75.95 -16.73 59.96 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.7 tp -92.78 -57.71 2.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.982 0.42 . . . . 0.0 111.093 -179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 m -87.17 -14.17 41.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.637 0.732 . . . . 0.0 110.885 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.455 ' HA ' ' O ' ' A' ' 42' ' ' ASN . 77.1 mt-30 60.02 47.84 9.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.576 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -119.32 169.36 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.627 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -109.7 138.25 46.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.502 0.668 . . . . 0.0 111.351 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.605 HD23 ' HA ' ' A' ' 60' ' ' PRO . 18.2 mt -134.99 169.55 17.24 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.319 -173.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.466 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 34.2 p90 -150.06 149.92 31.0 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.485 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.0 t-105 -83.59 119.05 24.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.81 0.338 . . . . 0.0 110.347 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.412 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 32.5 t70 -104.23 133.91 48.35 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.949 174.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.79 -11.61 85.26 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.341 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.412 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 11.2 tp10 -90.12 -49.42 6.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.168 0.508 . . . . 0.0 110.043 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -80.77 -18.09 48.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.568 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 46.38 61.99 2.5 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.438 0.637 . . . . 0.0 111.448 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.485 HG23 HG13 ' A' ' 59' ' ' VAL . 14.7 t -169.95 170.19 7.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.149 -0.932 . . . . 0.0 108.713 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -89.56 99.74 12.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.485 HG13 HG23 ' A' ' 57' ' ' THR . 3.3 m -95.7 145.55 29.75 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.458 -176.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.605 ' HA ' HD23 ' A' ' 49' ' ' LEU . 27.6 Cg_endo -62.27 122.93 11.57 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.659 2.239 . . . . 0.0 112.321 -177.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.135 179.35 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.283 0 CA-C-O 120.61 0.243 . . . . 0.0 111.062 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 29.9 m -63.62 137.62 97.14 Favored Pre-proline 0 C--O 1.236 0.368 0 CA-C-O 121.154 0.502 . . . . 0.0 110.844 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 76.1 Cg_endo -88.58 132.81 2.57 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.905 2.403 . . . . 0.0 113.125 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -96.1 135.27 38.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.267 173.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.46 HG22 ' CE2' ' A' ' 15' ' ' TYR . 25.7 p -87.82 -6.57 58.06 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.157 0.503 . . . . 0.0 110.92 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -81.76 -8.7 59.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.357 178.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.6 p -105.0 18.29 22.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.786 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.46 ' CE2' HG22 ' A' ' 12' ' ' THR . 21.9 m-30 -100.93 171.22 7.78 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -117.55 104.93 11.54 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -66.11 117.13 8.0 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.312 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -97.14 130.56 44.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.153 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -84.21 -23.62 30.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.873 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.0 t -73.33 -30.18 63.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.208 -178.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.9 m -107.57 -30.25 8.72 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.065 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.91 8.15 67.51 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.475 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -119.86 165.13 15.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.85 0.357 . . . . 0.0 110.725 -176.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -88.27 111.6 21.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.711 175.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.69 128.96 36.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.67 101.02 10.65 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.979 174.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -67.14 -17.23 50.42 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.917 2.411 . . . . 0.0 112.341 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -65.9 -58.99 4.31 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.855 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.65 -34.6 9.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.046 -177.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 37.61 1.92 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.458 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 83.2 mt -119.12 178.84 4.36 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.872 0.368 . . . . 0.0 110.588 -174.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -127.11 125.08 40.63 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.012 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -91.17 123.41 34.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.96 114.97 62.77 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.141 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -66.82 -12.67 36.93 Favored 'Trans proline' 0 C--O 1.233 0.236 0 C-N-CA 122.584 2.189 . . . . 0.0 112.209 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -87.02 -53.09 5.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.811 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.492 ' HB2' ' HD2' ' A' ' 39' ' ' TYR . 37.1 p -89.6 -20.03 24.23 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.094 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 68.9 26.53 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.291 0.636 . . . . 0.0 110.78 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . 0.504 ' HD1' ' HB3' ' A' ' 50' ' ' TYR . 63.2 m-85 -115.29 166.14 12.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.415 176.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -98.69 142.27 30.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.356 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -116.73 118.75 33.41 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.72 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.4 t-20 -79.39 114.13 18.08 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 t -74.49 -13.31 60.67 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.941 -0.303 . . . . 0.0 111.065 -174.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -87.46 -50.97 6.19 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.774 0.321 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.0 p -96.27 -13.03 23.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.634 -175.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 65.34 35.42 7.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.25 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -107.89 174.57 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.01 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -116.23 145.61 42.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.939 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.796 HD23 ' HA ' ' A' ' 60' ' ' PRO . 13.9 mt -138.54 170.19 16.44 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.322 -177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.504 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 37.6 p90 -148.3 146.38 28.55 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -82.51 114.47 20.95 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.697 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -98.34 121.17 39.94 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.43 -18.08 79.44 Favored Glycine 0 N--CA 1.452 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 113.303 -172.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -86.83 -40.4 14.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.151 0.5 . . . . 0.0 109.918 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -89.17 -11.09 44.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.581 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 60.82 41.02 15.18 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.805 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.631 HG23 HG13 ' A' ' 59' ' ' VAL . 8.8 t -155.58 152.62 29.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.757 0.313 . . . . 0.0 111.058 -176.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -83.15 106.22 14.77 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.631 HG13 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -101.46 138.04 19.79 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.53 -172.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.796 ' HA ' HD23 ' A' ' 49' ' ' LEU . 33.1 Cg_exo -57.83 122.72 12.23 Favored 'Trans proline' 0 CA--C 1.515 -0.448 0 C-N-CA 123.175 2.583 . . . . 0.0 112.9 -175.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.695 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.908 179.25 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.546 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.418 HG12 ' HE1' ' A' ' 51' ' ' TRP . 20.6 m -54.38 128.67 59.93 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 120.982 0.42 . . . . 0.0 111.139 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 62.9 Cg_endo -86.42 132.09 3.61 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 122.566 2.178 . . . . 0.0 112.622 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -94.91 128.85 41.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.257 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.603 HG22 ' CE2' ' A' ' 15' ' ' TYR . 42.4 p -81.21 -4.77 56.51 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.428 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -70.56 -26.19 63.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.095 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -94.42 12.12 28.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.844 0.354 . . . . 0.0 111.416 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.603 ' CE2' HG22 ' A' ' 12' ' ' THR . 18.2 m-30 -86.4 167.11 15.02 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -114.71 111.5 21.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.687 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -68.31 120.27 14.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.99 0.424 . . . . 0.0 110.508 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -98.42 121.61 40.57 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 176.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -84.13 -18.37 37.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.152 0.501 . . . . 0.0 111.387 -175.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -86.72 -24.45 25.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.3 t -101.64 -30.81 11.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.285 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 8.09 75.38 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.668 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.551 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 68.2 m-85 -123.76 160.76 26.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 0.0 111.048 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.446 ' HE1' ' HB3' ' A' ' 35' ' ' PRO . 72.4 m-85 -86.86 111.33 20.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.082 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -74.51 124.13 26.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.987 0.422 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.484 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 13.5 t70 -94.84 116.51 66.44 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.073 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 3.0 Cg_endo -84.65 -13.72 6.9 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.042 2.495 . . . . 0.0 111.9 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -68.66 -53.78 20.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.554 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.75 -36.75 8.17 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.642 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 105.22 40.0 2.17 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.243 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.7 mt -121.11 173.3 7.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.863 0.363 . . . . 0.0 110.646 -173.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.485 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 44.5 m-85 -115.07 125.38 53.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.405 175.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.433 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 59.6 t80 -92.44 117.01 29.49 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . 0.551 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 10.3 t70 -77.13 111.85 19.34 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.446 ' HB3' ' HE1' ' A' ' 24' ' ' TYR . 27.4 Cg_endo -67.03 -19.44 51.65 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.302 2.001 . . . . 0.0 113.38 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -89.83 -49.1 6.82 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.686 0.279 . . . . 0.0 111.104 -175.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.1 m -93.76 -17.05 23.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 111.373 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 63.46 37.38 10.66 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.942 178.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -114.56 161.22 18.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.399 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -97.33 137.75 35.85 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.332 178.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . 0.485 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 45.8 t80 -111.36 117.79 34.07 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.917 -179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.465 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 47.1 t-20 -79.12 113.1 16.98 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.3 t -77.08 -15.06 59.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.752 -0.203 . . . . 0.0 111.511 -174.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 tp -91.53 -43.2 9.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.973 0.415 . . . . 0.0 110.7 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 m -97.61 -13.46 21.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.3 0.572 . . . . 0.0 111.133 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 62.88 43.58 6.8 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.041 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.465 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 15.3 pt20 -122.5 166.59 14.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.014 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -108.94 141.47 40.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 110.865 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.598 HD23 ' HA ' ' A' ' 60' ' ' PRO . 14.1 mt -135.2 164.98 26.46 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.412 -172.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 42.3 p90 -140.01 145.69 38.1 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TRP . . . . . 0.418 ' HE1' HG12 ' A' ' 9' ' ' VAL . 70.0 t-105 -76.98 123.3 26.13 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.161 176.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.98 120.38 41.62 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.73 -10.2 86.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.294 -174.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -97.09 -43.43 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.407 ' HD2' HG21 ' A' ' 59' ' ' VAL . 80.5 mttt -80.2 -18.27 50.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.36 179.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 58.68 48.54 11.47 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . 0.649 HG23 HG22 ' A' ' 59' ' ' VAL . 9.9 t -159.05 156.64 29.61 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.451 -175.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -85.07 108.32 17.59 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 171.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.649 HG22 HG23 ' A' ' 57' ' ' THR . 0.2 OUTLIER -102.1 143.44 26.61 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.535 -173.702 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' PRO . . . . . 0.633 ' HD2' HG12 ' A' ' 59' ' ' VAL . 45.7 Cg_exo -56.06 130.22 39.09 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.684 2.256 . . . . 0.0 111.955 177.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.562 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.751 -176.688 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.641 0 N-CA-C 112.285 -0.326 . . . . 0.0 112.285 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 70.42 -62.17 0.44 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 123.531 0.732 . . . . 0.0 111.793 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.2 mmt -93.38 47.26 1.24 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.958 0.408 . . . . 0.0 110.77 -176.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.85 53.46 0.21 Allowed Glycine 0 N--CA 1.449 -0.467 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.056 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 8.0 p -69.21 97.72 0.95 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.048 0.452 . . . . 0.0 111.24 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -95.79 -43.7 7.75 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.236 -177.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.737 ' HB3' ' HH2' ' A' ' 51' ' ' TRP . 69.8 m-85 -131.5 97.83 4.34 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.574 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -89.72 174.72 7.57 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.344 178.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.628 HG12 ' HE1' ' A' ' 51' ' ' TRP . 16.8 m -67.18 118.34 54.96 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-O 121.144 0.497 . . . . 0.0 110.805 179.124 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -71.51 131.62 19.13 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.262 1.974 . . . . 0.0 112.035 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.457 ' OD2' HG23 ' A' ' 14' ' ' THR . 9.1 p-10 -105.51 120.8 42.54 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 175.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.517 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 29.0 p -71.09 7.11 1.32 Allowed 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.69 -176.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.1 m -86.25 -12.46 49.55 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 175.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.457 HG23 ' OD2' ' A' ' 11' ' ' ASP . 40.0 p -99.77 11.22 39.81 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-O 121.162 0.506 . . . . 0.0 110.521 173.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.517 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -92.95 169.34 10.51 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.843 -177.463 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -119.51 103.94 9.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.748 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.458 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 92.5 t80 -65.54 117.56 8.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.096 0.474 . . . . 0.0 110.638 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -93.73 105.9 17.91 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 177.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -71.6 -26.83 62.75 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.008 0.432 . . . . 0.0 111.123 -173.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.4 t -73.73 -28.3 61.64 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.854 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.1 t -100.88 -31.18 11.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.924 -178.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.36 11.58 60.84 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.193 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -123.13 157.53 32.72 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.747 0.308 . . . . 0.0 110.765 -177.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.63 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.0 m-85 -87.28 116.22 25.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 171.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -74.36 128.1 34.7 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.288 -179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' HB2' ' CE2' ' A' ' 15' ' ' TYR . 8.9 t70 -102.51 98.9 11.72 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.696 179.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -13.44 24.69 Favored 'Trans proline' 0 C--O 1.234 0.292 0 C-N-CA 122.805 2.337 . . . . 0.0 112.413 172.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.45 -47.28 70.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.058 0.456 . . . . 0.0 110.649 -177.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.7 m -114.38 -41.09 3.51 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.49 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 116.9 38.67 0.87 Allowed Glycine 0 N--CA 1.449 -0.476 0 N-CA-C 111.184 -0.766 . . . . 0.0 111.184 -178.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 74.7 mt -123.83 176.59 6.2 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.113 0.482 . . . . 0.0 110.911 -175.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -115.16 125.31 53.27 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.365 175.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.63 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 84.3 t80 -93.52 121.15 34.63 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.288 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -83.76 112.64 41.69 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 176.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.602 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.8 Cg_endo -63.06 -23.56 73.66 Favored 'Trans proline' 0 C--O 1.231 0.14 0 C-N-CA 122.731 2.287 . . . . 0.0 113.341 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -87.18 -49.49 7.26 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.048 0.451 . . . . 0.0 110.632 -174.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.2 m -86.77 -20.59 27.38 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.119 -177.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 66.38 32.43 7.61 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 115.199 -0.91 . . . . 0.0 111.426 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -119.54 162.21 19.31 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.383 178.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -95.76 140.26 30.82 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.349 179.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -114.5 120.15 39.28 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.006 -176.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.46 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 48.2 t-20 -83.21 112.87 20.24 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.9 t -74.54 -13.55 60.69 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -173.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 62.9 tp -89.76 -46.45 8.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.73 0.3 . . . . 0.0 110.876 -179.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.8 m -99.19 -5.78 29.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.24 0.543 . . . . 0.0 110.976 -176.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 61.67 30.38 18.49 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.195 176.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.46 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 21.1 pt20 -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.795 -176.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -113.68 140.72 48.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.831 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.514 HD23 ' HA ' ' A' ' 60' ' ' PRO . 19.5 mt -136.11 165.06 26.58 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.478 -173.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.406 ' CE2' ' HB ' ' A' ' 59' ' ' VAL . 39.3 p90 -140.98 156.84 45.98 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 174.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.737 ' HH2' ' HB3' ' A' ' 7' ' ' TYR . 72.0 t-105 -88.99 125.6 35.05 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.878 0.37 . . . . 0.0 111.013 -179.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -103.99 124.41 48.96 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -72.33 -20.63 79.37 Favored Glycine 0 N--CA 1.452 -0.258 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.314 -173.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -85.98 -50.93 6.69 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.821 0.311 . . . . 0.0 110.74 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.12 -18.65 60.77 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.262 -177.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 56.86 48.7 15.5 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.407 -177.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 14.5 t -156.32 169.57 24.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.497 -177.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -99.83 118.62 36.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.857 178.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.682 HG12 ' HD2' ' A' ' 60' ' ' PRO . 0.9 OUTLIER -107.09 144.95 30.16 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 -177.748 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.682 ' HD2' HG12 ' A' ' 59' ' ' VAL . 39.8 Cg_exo -55.16 122.4 11.63 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.631 2.221 . . . . 0.0 112.119 178.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -72.55 -29.89 63.96 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.047 -177.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -75.65 87.8 2.74 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -64.11 91.04 0.07 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.277 -175.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 3.1 p . . . . . 0 C--O 1.251 1.166 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.279 179.862 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.609 0 N-CA-C 111.718 -0.553 . . . . 0.0 111.718 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.81 -50.96 0.21 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.889 0.376 . . . . 0.0 110.808 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 86.1 mtp -110.29 99.17 8.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.338 -178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 145.59 168.1 12.89 Favored Glycine 0 N--CA 1.447 -0.594 0 N-CA-C 111.474 -0.65 . . . . 0.0 111.474 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.0 p -83.51 -173.11 4.53 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.739 0.269 . . . . 0.0 110.581 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -63.12 -54.07 43.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.155 0.502 . . . . 0.0 109.858 176.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 99.4 m-85 -133.94 101.26 5.0 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.26 -0.882 . . . . 0.0 109.456 177.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -93.58 179.54 5.35 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.531 179.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.672 HG12 ' HE1' ' A' ' 51' ' ' TRP . 10.0 m -64.93 115.64 22.69 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.181 0.515 . . . . 0.0 110.581 178.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.414 ' HB2' ' OH ' ' A' ' 15' ' ' TYR . 29.2 Cg_endo -64.25 132.54 34.26 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 123.411 2.74 . . . . 0.0 114.056 -172.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -100.65 119.46 38.61 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.049 174.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.431 HG22 ' CE1' ' A' ' 15' ' ' TYR . 25.3 p -69.66 -10.95 60.32 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.923 0.392 . . . . 0.0 111.778 -175.279 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 48.4 t -69.46 -18.49 63.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.926 175.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.1 p -95.98 9.31 41.13 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.911 0.386 . . . . 0.0 110.882 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.431 ' CE1' HG22 ' A' ' 12' ' ' THR . 9.0 m-30 -91.34 164.5 13.83 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.191 0.519 . . . . 0.0 111.199 -177.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -117.57 104.66 11.27 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.647 176.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 60.8 t80 -62.58 113.38 2.94 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.563 -179.418 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.4 t0 -87.93 96.26 10.42 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -68.61 -18.28 64.28 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.087 0.47 . . . . 0.0 111.318 -175.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.8 t -86.51 -15.03 41.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.368 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 46.6 t -108.98 -30.57 8.02 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.136 0.493 . . . . 0.0 110.452 177.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 93.63 11.15 58.39 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.352 178.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -133.39 158.22 43.56 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.821 0.343 . . . . 0.0 110.61 -177.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 17' ' ' TYR . 63.8 m-85 -79.31 117.76 20.6 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.938 174.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.515 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 61.8 t80 -76.8 122.04 24.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-O 120.819 0.342 . . . . 0.0 110.533 179.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.63 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.9 OUTLIER -83.62 103.06 2.34 Favored Pre-proline 0 C--N 1.323 -0.565 0 CA-C-N 115.223 -0.899 . . . . 0.0 109.414 173.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.515 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 5.9 Cg_exo -78.51 -15.21 14.03 Favored 'Trans proline' 0 N--CA 1.46 -0.447 0 C-N-CA 122.632 2.221 . . . . 0.0 110.972 -178.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 5.0 p -75.26 -49.26 19.85 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.882 -1.054 . . . . 0.0 111.704 -179.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.8 m -105.83 -28.52 10.59 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.988 0.423 . . . . 0.0 111.914 -177.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.42 41.25 3.47 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.677 -176.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.63 ' H ' ' HB2' ' A' ' 26' ' ' ASP . 81.9 mt -125.12 -170.89 2.25 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 110.184 -0.302 . . . . 0.0 110.184 -175.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.415 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 52.1 m-85 -136.82 124.79 22.77 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.223 174.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 74.1 t80 -90.74 121.79 32.93 Favored 'General case' 0 C--N 1.313 -0.997 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 175.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 18.6 t0 -87.22 115.46 62.76 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.834 175.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -60.94 -24.67 79.93 Favored 'Trans proline' 0 N--CA 1.464 -0.225 0 C-N-CA 122.616 2.211 . . . . 0.0 112.788 178.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -84.2 -53.22 5.66 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.933 -0.307 . . . . 0.0 111.06 -175.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.501 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 19.2 m -80.15 -23.0 41.41 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.889 0.376 . . . . 0.0 111.487 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 65.97 25.73 10.99 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.659 -175.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.501 ' HD2' ' HB3' ' A' ' 37' ' ' SER . 60.1 m-85 -114.17 167.63 10.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.142 177.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.43 ' O ' ' HA ' ' A' ' 48' ' ' TYR . 93.5 m-85 -101.27 144.99 29.44 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.526 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.415 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 41.0 t80 -116.91 113.72 22.84 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.045 -178.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.498 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 53.9 t-20 -75.54 104.03 5.92 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 172.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -73.36 -19.61 60.97 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.892 0.377 . . . . 0.0 110.903 -174.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.6 tp -79.84 -41.7 25.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.964 -178.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 m -101.72 -12.2 18.55 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.365 0.602 . . . . 0.0 111.113 -177.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 62.93 63.65 0.93 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.995 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.498 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 19.6 pt20 -148.15 168.34 22.68 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.224 -177.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.43 ' HA ' ' O ' ' A' ' 40' ' ' TYR . 26.8 m-85 -113.65 143.33 44.76 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.378 0.609 . . . . 0.0 111.581 -178.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 60' ' ' PRO . 30.2 mt -140.02 169.31 17.95 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.591 -172.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -142.02 144.86 33.85 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 171.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.672 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.1 t-105 -77.42 113.34 15.11 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.202 -178.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.463 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 14.1 t70 -97.28 117.55 31.76 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 172.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -69.41 -24.88 75.93 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.163 -0.541 . . . . 0.0 112.853 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.463 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 29.9 tt0 -71.33 -47.72 54.84 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.334 0.588 . . . . 0.0 110.547 -178.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.3 mttp -87.06 -14.95 40.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.702 -176.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 59.41 41.84 18.87 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.535 -178.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.591 HG23 HG13 ' A' ' 59' ' ' VAL . 13.0 t -150.96 155.59 39.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.526 -177.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 82.2 m-85 -87.27 105.25 17.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.591 HG13 HG23 ' A' ' 57' ' ' THR . 1.1 m -100.46 148.18 34.6 Favored Pre-proline 0 C--N 1.316 -0.851 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.628 -176.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.525 ' HA ' HD23 ' A' ' 49' ' ' LEU . 31.8 Cg_exo -58.87 128.72 29.01 Favored 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 123.096 2.531 . . . . 0.0 112.867 -177.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.97 -7.71 57.18 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.433 176.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -85.28 90.23 7.86 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.294 177.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -84.86 -13.8 49.84 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.443 -179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.247 0.929 0 CA-C-O 118.598 -0.715 . . . . 0.0 110.216 177.86 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.687 0 N-CA-C 111.402 -0.679 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 71.9 139.57 0.05 Allowed 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.243 0.617 . . . . 0.0 111.638 178.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 87.9 mtp 65.61 26.25 11.6 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.805 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -90.67 -91.14 1.31 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.287 179.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.54 90.75 3.33 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.468 0.652 . . . . 0.0 110.736 178.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.424 ' HE2' ' HB2' ' A' ' 6' ' ' LYS . 31.9 mtmm -98.54 -49.22 4.71 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.779 -178.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -131.94 108.25 9.25 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.366 177.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -104.97 -169.26 1.58 Allowed 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.175 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.525 HG12 ' HE1' ' A' ' 51' ' ' TRP . 16.9 m -60.09 119.73 44.52 Favored Pre-proline 0 C--N 1.327 -0.377 0 CA-C-O 121.291 0.567 . . . . 0.0 110.827 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.411 ' HB2' ' OH ' ' A' ' 15' ' ' TYR . 73.9 Cg_endo -81.24 132.77 8.37 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 122.714 2.276 . . . . 0.0 112.673 -177.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -96.95 127.23 42.72 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.179 178.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.0 p -87.02 -7.69 57.87 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -174.14 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 27.9 m -71.01 -39.41 72.41 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.167 0.508 . . . . 0.0 109.878 178.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.8 t -84.35 8.28 16.65 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.202 -178.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.559 ' HE2' ' HE1' ' A' ' 40' ' ' TYR . 7.5 m-30 -80.02 161.58 25.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.226 177.082 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -104.65 104.15 13.92 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.621 -175.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -60.94 112.95 2.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.312 0.577 . . . . 0.0 111.324 -175.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -82.89 96.78 8.37 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 177.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -73.84 -22.52 59.75 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.18 -172.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 16.4 m -81.1 -19.39 43.72 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.089 -179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 12.8 t -109.92 -30.39 7.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.061 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.19 37.22 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.321 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.602 ' HB2' ' HD1' ' A' ' 32' ' ' TYR . 95.1 m-85 -136.14 161.43 35.76 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.602 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 59.4 m-85 -81.2 116.33 21.04 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 110.281 -0.266 . . . . 0.0 110.281 175.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -74.7 129.47 37.77 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.032 0.444 . . . . 0.0 110.263 177.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.42 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.9 t70 -102.83 99.36 13.48 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.206 177.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 56.8 Cg_endo -72.68 -11.82 26.3 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.078 2.519 . . . . 0.0 112.446 175.346 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -70.96 -58.18 3.84 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.846 0.355 . . . . 0.0 110.834 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.9 m -101.1 -39.86 7.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.062 0.458 . . . . 0.0 110.349 179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 114.34 40.96 0.91 Allowed Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.424 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 80.6 mt -124.06 173.5 8.23 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.994 0.426 . . . . 0.0 111.4 -175.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.602 ' HD1' ' HB2' ' A' ' 23' ' ' TYR . 20.1 m-85 -112.69 125.31 54.16 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.227 174.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.602 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 85.4 t80 -96.71 120.11 36.42 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 179.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.566 ' HA ' ' HD2' ' A' ' 23' ' ' TYR . 21.8 t0 -84.1 114.28 53.37 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 175.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_endo -61.76 -23.39 76.13 Favored 'Trans proline' 0 N--CA 1.464 -0.236 0 C-N-CA 122.562 2.175 . . . . 0.0 112.642 178.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.41 HD22 ' HA ' ' A' ' 36' ' ' ASN . 3.3 t-20 -83.9 -53.27 5.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.944 0.402 . . . . 0.0 111.156 -176.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 14.7 m -82.62 -21.3 35.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.214 -179.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 65.45 30.33 10.88 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.882 -176.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.418 ' HD2' ' HB3' ' A' ' 50' ' ' TYR . 30.9 m-85 -116.23 158.78 22.8 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.275 179.028 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . 0.559 ' HE1' ' HE2' ' A' ' 15' ' ' TYR . 90.1 m-85 -96.09 137.65 34.85 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.305 178.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -110.53 115.83 30.3 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.047 -178.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.434 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 49.8 t-20 -78.51 110.52 13.68 Favored 'General case' 0 C--N 1.314 -0.963 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 174.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.6 t -72.25 -26.64 62.08 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 120.823 0.344 . . . . 0.0 111.041 -175.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 46.1 tp -80.63 -44.2 19.26 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.892 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.3 m -98.6 -7.36 28.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.418 0.628 . . . . 0.0 111.215 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 22.9 mt-30 59.56 43.44 15.96 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.148 -0.933 . . . . 0.0 111.522 176.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 4.2 pt20 -124.95 162.51 24.31 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.621 -176.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -107.19 139.36 41.75 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.223 0.535 . . . . 0.0 110.908 178.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.621 HD23 ' HA ' ' A' ' 60' ' ' PRO . 27.0 mt -137.52 166.3 24.22 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.825 -174.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.731 ' HD1' ' HB2' ' A' ' 61' ' ' ALA . 43.2 p90 -146.85 146.92 30.37 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 172.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.525 ' HE1' HG12 ' A' ' 9' ' ' VAL . 59.5 t-105 -80.26 116.48 20.37 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.372 -179.04 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.507 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 12.5 t70 -100.56 113.13 25.7 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 172.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -64.77 -23.62 69.23 Favored Glycine 0 N--CA 1.453 -0.217 0 CA-C-N 116.083 -0.508 . . . . 0.0 113.543 -173.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -75.73 -48.32 22.36 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.036 0.446 . . . . 0.0 110.078 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.507 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 26.1 mmmt -79.26 -18.22 53.19 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.059 -176.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 61.9 38.64 14.36 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.441 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.485 HG23 HG13 ' A' ' 59' ' ' VAL . 7.4 t -149.76 162.36 40.41 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.528 -177.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 81.1 m-85 -92.62 108.78 20.24 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.485 HG13 HG23 ' A' ' 57' ' ' THR . 3.7 m -103.26 140.0 20.65 Favored Pre-proline 0 C--N 1.317 -0.844 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.837 -173.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.621 ' HA ' HD23 ' A' ' 49' ' ' LEU . 52.9 Cg_exo -56.27 122.97 12.73 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.338 2.692 . . . . 0.0 112.778 -176.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.731 ' HB2' ' HD1' ' A' ' 50' ' ' TYR . . . -99.73 -2.8 34.36 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.577 -177.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -146.68 42.9 1.17 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.741 0.305 . . . . 0.0 111.357 -178.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -75.65 -17.97 59.82 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.077 0.465 . . . . 0.0 110.16 177.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 32.7 m . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.604 176.857 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 N-CA-C 111.871 -0.492 . . . . 0.0 111.871 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 55.26 53.03 10.56 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.096 0.474 . . . . 0.0 111.344 179.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.2 ptm -137.45 18.19 2.92 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.901 -178.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -77.74 52.39 3.55 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.602 179.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 20.9 m -79.75 125.17 29.33 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 121.125 0.488 . . . . 0.0 110.826 -179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -102.84 -41.26 6.23 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.672 0.749 . . . . 0.0 109.503 179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -113.32 128.56 56.5 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.626 -178.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.01 -173.63 2.35 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 177.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 17.8 m -54.84 119.16 20.08 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.372 0.606 . . . . 0.0 109.983 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -77.46 132.55 12.39 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 122.678 2.252 . . . . 0.0 113.402 -170.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -81.29 133.06 35.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.279 174.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.436 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 12.6 p -94.65 -14.99 24.36 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 121.072 0.463 . . . . 0.0 110.741 179.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -76.0 -17.9 59.51 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.666 177.501 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 12.7 p -89.72 0.77 56.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.131 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.436 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 21.4 m-30 -85.18 158.87 20.25 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.551 -179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -100.86 103.56 14.75 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.745 -0.662 . . . . 0.0 109.477 178.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.419 ' HA ' ' HA ' ' A' ' 24' ' ' TYR . 81.7 t80 -66.82 116.68 7.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.809 0.338 . . . . 0.0 110.576 -177.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -96.01 113.44 25.06 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.9 -16.99 56.29 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.209 0.528 . . . . 0.0 111.522 -175.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.4 t -88.37 -19.29 26.82 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.893 -179.032 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.5 t -105.29 -30.5 9.6 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.305 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.02 22.71 44.2 Favored Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.637 -0.71 . . . . 0.0 112.3 178.044 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.419 ' HB2' ' HD2' ' A' ' 32' ' ' TYR . 86.7 m-85 -139.23 156.05 47.36 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.017 0.437 . . . . 0.0 111.082 -176.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.458 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 62.7 m-85 -82.07 110.85 17.68 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.918 171.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -74.66 126.84 31.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.647 -0.251 . . . . 0.0 110.66 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -97.95 102.21 12.98 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.07 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo -67.57 -16.97 48.15 Favored 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 123.141 2.561 . . . . 0.0 112.801 175.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.2 m -69.61 -65.79 0.67 Allowed 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 120.874 0.369 . . . . 0.0 110.809 -176.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.1 m -91.53 -33.72 15.05 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.413 -178.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 104.88 41.53 1.96 Allowed Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.291 179.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.518 HD22 ' HA ' ' A' ' 42' ' ' ASN . 95.7 mt -121.88 176.19 5.9 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.596 -0.302 . . . . 0.0 110.631 -175.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.419 ' HD2' ' HB2' ' A' ' 23' ' ' TYR . 51.1 m-85 -123.9 125.77 45.21 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.084 174.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.458 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 87.6 t80 -96.2 125.68 40.89 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.534 0.207 . . . . 0.0 110.448 179.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 21.9 t0 -89.3 117.36 68.13 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 175.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -66.99 -19.72 51.61 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.531 2.154 . . . . 0.0 112.726 178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -86.57 -51.18 6.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.81 0.338 . . . . 0.0 111.148 -176.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 13.4 m -82.55 -19.77 37.91 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.193 0.521 . . . . 0.0 110.891 179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.1 mt-30 63.34 30.72 15.54 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.956 -177.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -119.55 163.86 16.69 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.999 177.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 83.7 m-85 -97.42 153.12 18.31 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.433 178.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -124.22 121.86 36.22 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.426 -0.807 . . . . 0.0 109.785 -176.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.518 ' HA ' HD22 ' A' ' 31' ' ' LEU . 45.0 t-20 -78.68 116.41 19.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 m -66.21 -25.45 66.93 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.822 -172.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -91.5 -50.49 5.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.828 0.347 . . . . 0.0 111.416 -176.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.1 m -87.08 -13.94 42.84 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.556 0.693 . . . . 0.0 110.896 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 60.69 39.51 17.46 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.106 177.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -113.67 168.29 9.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.162 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 34.5 m-85 -105.67 140.53 38.59 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.457 0.646 . . . . 0.0 111.233 179.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.68 HD23 ' HA ' ' A' ' 60' ' ' PRO . 11.9 mt -134.94 171.22 14.71 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.312 -174.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.448 ' CE1' HG23 ' A' ' 59' ' ' VAL . 32.6 p90 -148.01 153.79 39.42 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 173.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 59.5 t-105 -83.7 122.37 28.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.911 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -106.86 124.17 49.23 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 172.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -73.94 -15.01 79.82 Favored Glycine 0 N--CA 1.454 -0.157 0 C-N-CA 121.02 -0.609 . . . . 0.0 113.168 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -87.54 -47.98 8.29 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.703 0.287 . . . . 0.0 110.527 -177.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -81.4 -15.17 56.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.059 0.457 . . . . 0.0 110.825 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 60.66 41.45 15.16 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 115.015 -0.993 . . . . 0.0 111.376 174.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 11.8 t -158.6 169.39 24.52 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.861 -178.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 77.7 m-85 -91.92 112.27 24.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 179.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.448 HG23 ' CE1' ' A' ' 50' ' ' TYR . 2.5 m -106.56 146.84 33.84 Favored Pre-proline 0 C--N 1.318 -0.774 0 CA-C-N 115.531 -0.758 . . . . 0.0 110.328 -176.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.68 ' HA ' HD23 ' A' ' 49' ' ' LEU . 38.8 Cg_exo -57.25 122.76 12.37 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.968 2.445 . . . . 0.0 113.023 -175.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -79.52 -12.79 59.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.882 177.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -107.49 31.66 5.26 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.262 177.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -76.5 112.94 13.56 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.736 177.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 C--O 1.251 1.144 0 CA-C-O 118.462 -0.78 . . . . 0.0 110.189 178.907 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.755 0 N-CA-C 112.01 -0.436 . . . . 0.0 112.01 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -96.27 7.52 46.25 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.819 0.342 . . . . 0.0 111.178 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 66.5 mtt -85.8 68.5 10.38 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.159 0.504 . . . . 0.0 110.343 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -149.55 29.78 1.17 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.813 -0.708 . . . . 0.0 111.968 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 30.8 m -72.76 129.63 38.65 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 49.4 mttp -128.52 -74.46 0.57 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.177 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 -94.61 131.51 40.3 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.437 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -128.16 176.54 7.58 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.978 178.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.409 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 32.5 m -60.33 133.75 90.87 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 121.065 0.46 . . . . 0.0 110.929 178.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 24.9 Cg_endo -85.58 152.99 10.34 Favored 'Trans proline' 0 N--CA 1.455 -0.759 0 C-N-CA 123.017 2.478 . . . . 0.0 112.904 -178.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.676 ' O ' ' HB ' ' A' ' 14' ' ' THR . 12.7 t70 -121.9 127.06 50.02 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.485 176.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.467 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 67.7 p -86.85 5.7 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -170.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.1 t -87.17 -23.42 24.82 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.998 -1.482 . . . . 0.0 106.998 172.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.676 ' HB ' ' O ' ' A' ' 11' ' ' ASP . 1.8 m -75.3 -17.95 60.16 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 112.747 -2.024 . . . . 0.0 109.948 176.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.467 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 2.7 m-30 -78.07 164.06 25.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.338 -177.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -112.21 102.81 10.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.443 -0.798 . . . . 0.0 109.63 -177.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.516 ' HB2' ' CE1' ' A' ' 24' ' ' TYR . 89.6 t80 -72.57 128.19 34.83 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 120.838 0.351 . . . . 0.0 111.697 -174.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.5 t0 -108.55 130.36 55.29 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.172 172.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -84.0 -24.09 30.7 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.218 -177.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -75.63 -24.73 56.48 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.37 -177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 7.6 t -111.8 -30.27 7.37 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.408 -179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 85.12 23.96 46.45 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.541 -0.838 . . . . 0.0 111.934 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -125.75 155.5 40.9 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.896 0.379 . . . . 0.0 110.441 -179.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.636 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 70.6 m-85 -88.24 114.06 24.48 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.428 169.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -73.84 132.97 43.1 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 120.932 0.396 . . . . 0.0 110.369 -177.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.403 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 19.0 t70 -104.1 97.78 12.28 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.606 -179.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 56.4 Cg_endo -72.26 -12.89 28.03 Favored 'Trans proline' 0 C--O 1.233 0.263 0 C-N-CA 122.875 2.384 . . . . 0.0 112.057 173.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -63.01 -51.9 65.0 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.768 -178.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 3.6 m -117.19 -41.14 3.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.933 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 123.21 38.57 0.55 Allowed Glycine 0 CA--C 1.509 -0.34 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 88.1 mt -115.01 175.68 5.39 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.139 0.495 . . . . 0.0 111.11 -174.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.407 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 47.0 m-85 -123.33 125.22 44.61 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.799 171.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.619 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.8 t80 -93.06 122.94 35.94 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-O 120.602 0.239 . . . . 0.0 110.434 -179.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -85.17 111.35 35.55 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 175.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.636 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 16.3 Cg_endo -63.98 -25.87 66.6 Favored 'Trans proline' 0 C--O 1.236 0.388 0 C-N-CA 122.421 2.081 . . . . 0.0 113.549 -176.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -89.29 -43.75 10.73 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.903 0.382 . . . . 0.0 111.294 -176.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 5.1 m -88.22 -18.08 29.43 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.913 -177.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 63.08 25.54 15.0 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.89 178.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -107.85 167.6 9.86 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.248 174.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -104.79 139.57 39.38 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.274 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.407 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 47.0 t80 -109.11 114.39 28.07 Favored 'General case' 0 C--N 1.309 -1.157 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.573 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.463 ' HB2' HD11 ' A' ' 49' ' ' LEU . 47.0 t-20 -73.57 113.45 10.7 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.39 179.273 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 12.9 t -73.06 -17.34 61.43 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.998 0.427 . . . . 0.0 110.971 -176.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.5 tp -87.94 -51.38 5.86 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.995 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.6 m -94.68 -14.32 24.95 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.167 0.508 . . . . 0.0 111.364 -174.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 63.12 46.98 4.36 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.141 179.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -129.79 163.9 25.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.489 -0.778 . . . . 0.0 109.927 -179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -99.3 139.19 35.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.321 0.581 . . . . 0.0 111.131 -179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.525 HD23 ' HA ' ' A' ' 60' ' ' PRO . 15.3 mt -137.46 168.09 20.34 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.741 -170.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.403 ' HD2' ' HB2' ' A' ' 61' ' ' ALA . 35.4 p90 -144.27 149.94 37.11 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 173.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 62.2 t-105 -79.34 117.77 20.63 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.734 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.523 ' OD2' ' HG3' ' A' ' 55' ' ' LYS . 16.3 t70 -103.12 124.7 49.06 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 172.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.36 -12.02 84.72 Favored Glycine 0 N--CA 1.447 -0.617 0 CA-C-N 115.795 -0.639 . . . . 0.0 112.604 -177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -80.63 -52.1 7.96 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.013 0.435 . . . . 0.0 109.894 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.523 ' HG3' ' OD2' ' A' ' 52' ' ' ASP . 66.1 mttm -77.33 -18.57 57.35 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.3 179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 62.05 43.73 8.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.401 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 9.3 t -158.29 170.91 21.19 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.996 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -96.7 112.76 24.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.67 178.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.401 HG23 ' CE2' ' A' ' 50' ' ' TYR . 1.7 m -109.42 152.9 42.96 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.829 -177.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.525 ' HA ' HD23 ' A' ' 49' ' ' LEU . 11.9 Cg_endo -55.72 128.58 30.94 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 123.219 2.613 . . . . 0.0 112.663 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . . . -98.54 0.65 45.42 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.416 -177.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -142.33 81.0 1.73 Allowed 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.835 -179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -100.07 -36.62 9.29 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 48.8 m . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.309 -0.853 . . . . 0.0 109.895 175.745 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.631 0 N-CA-C 111.685 -0.566 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.41 -60.23 2.27 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.848 -0.426 . . . . 0.0 109.848 176.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 45.6 ttp 52.46 53.84 11.64 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.44 0.638 . . . . 0.0 111.161 174.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -137.63 29.7 2.65 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.675 -0.774 . . . . 0.0 111.915 179.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 6.9 p -90.22 88.01 7.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.215 0.531 . . . . 0.0 111.564 -179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -82.98 -37.07 24.54 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 176.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.82 101.18 4.67 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.787 -1.097 . . . . 0.0 109.249 174.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -105.38 -174.5 2.55 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.228 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.52 HG12 ' HE1' ' A' ' 51' ' ' TRP . 29.6 m -60.66 131.59 91.07 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.18 0.514 . . . . 0.0 111.077 -178.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -89.37 132.53 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 122.958 2.439 . . . . 0.0 112.951 -178.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -91.96 128.07 37.66 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.466 175.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.566 ' HA ' ' CD2' ' A' ' 15' ' ' TYR . 42.8 p -84.24 -11.58 56.22 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.089 0.471 . . . . 0.0 111.432 -177.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.1 m -73.46 -13.99 61.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.902 179.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 14.5 p -103.11 18.07 22.57 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.06 0.457 . . . . 0.0 111.093 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.566 ' CD2' ' HA ' ' A' ' 12' ' ' THR . 19.6 m-30 -98.72 171.72 7.92 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.657 178.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -109.34 103.49 12.43 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.037 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -60.01 118.67 6.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.169 0.509 . . . . 0.0 110.724 179.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -94.91 110.02 21.96 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.387 -0.824 . . . . 0.0 108.986 178.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -73.21 -23.75 60.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.198 0.523 . . . . 0.0 111.443 -174.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 47.7 t -77.13 -28.16 54.18 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.181 -179.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 m -102.06 -30.76 10.99 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.07 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.82 6.05 76.8 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.926 -0.654 . . . . 0.0 111.509 -178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.428 ' CE2' ' HB2' ' A' ' 34' ' ' ASP . 10.0 m-85 -114.25 161.38 17.92 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.307 -0.446 . . . . 0.0 110.19 -177.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -89.44 115.67 27.05 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.588 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 81.6 t80 -74.78 121.86 22.42 Favored 'General case' 0 C--N 1.318 -0.776 0 C-N-CA 120.593 -0.443 . . . . 0.0 110.763 -177.595 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.553 ' HB2' ' H ' ' A' ' 31' ' ' LEU . 0.8 OUTLIER -80.02 103.44 1.72 Allowed Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.097 -0.956 . . . . 0.0 109.975 174.333 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.588 ' HD3' ' O ' ' A' ' 25' ' ' TYR . 2.0 Cg_endo -80.85 -19.95 8.05 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 122.453 2.102 . . . . 0.0 110.67 177.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 2.6 m -85.08 -31.65 23.25 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.598 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.6 -18.62 13.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.979 -0.555 . . . . 0.0 112.264 -173.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.91 30.81 58.84 Favored Glycine 0 N--CA 1.454 -0.143 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 -176.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.82 HD22 ' HA ' ' A' ' 42' ' ' ASN . 71.0 mt -125.46 -175.83 3.43 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.466 -0.367 . . . . 0.0 110.559 -173.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.583 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 53.3 m-85 -125.62 125.1 42.59 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.74 171.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 73.4 t80 -91.38 121.62 33.27 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.859 -0.423 . . . . 0.0 109.859 176.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.428 ' HB2' ' CE2' ' A' ' 23' ' ' TYR . 33.9 t0 -83.17 117.8 69.72 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 175.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -67.66 -18.23 48.13 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.159 1.906 . . . . 0.0 112.414 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -86.93 -53.24 5.01 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.45 -0.341 . . . . 0.0 110.938 -176.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.646 ' HB2' ' HD1' ' A' ' 39' ' ' TYR . 68.0 p -89.08 -21.5 23.37 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.856 0.36 . . . . 0.0 111.525 -179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 68.11 23.96 7.86 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.52 -177.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.646 ' HD1' ' HB2' ' A' ' 37' ' ' SER . 74.8 m-85 -102.32 159.32 15.51 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.575 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.66 139.55 33.39 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.12 0.486 . . . . 0.0 110.569 179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.583 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 64.4 t80 -110.37 116.49 31.53 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.038 -176.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.82 ' HA ' HD22 ' A' ' 31' ' ' LEU . 45.7 t-20 -74.85 108.44 7.59 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 177.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 m -64.1 -27.03 68.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.874 0.369 . . . . 0.0 111.511 -174.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 53.8 tp -78.15 -50.97 10.96 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.486 -178.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 5.6 m -95.7 -8.63 34.11 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.343 0.592 . . . . 0.0 111.229 -172.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 20.7 mt-30 61.66 40.06 13.69 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.931 0.872 . . . . 0.0 109.469 -178.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.539 ' HG3' ' HG2' ' A' ' 63' ' ' GLU . 26.9 tt0 -111.31 165.85 11.6 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 113.969 -1.469 . . . . 0.0 110.218 -172.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.423 ' N ' ' HG2' ' A' ' 47' ' ' GLN . 30.9 m-85 -119.41 138.92 52.78 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.456 0.646 . . . . 0.0 111.34 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.622 HD23 ' HA ' ' A' ' 60' ' ' PRO . 20.0 mt -135.81 174.47 10.58 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.078 -0.965 . . . . 0.0 109.645 -176.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.578 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 46.6 p90 -149.96 146.85 27.27 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.52 ' HE1' HG12 ' A' ' 9' ' ' VAL . 65.1 t-105 -79.7 112.94 17.46 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 120.835 0.35 . . . . 0.0 110.204 178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.416 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 9.7 t70 -91.63 114.85 27.5 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.71 -14.19 82.77 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.85 -174.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.416 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 26.6 tt0 -79.21 -48.15 14.72 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.397 0.618 . . . . 0.0 109.774 178.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 38.8 mttp -87.94 -19.08 27.77 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.773 -177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 59.47 61.92 1.89 Allowed 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.593 -178.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 12.6 t -164.73 164.67 21.2 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.177 -178.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 68.8 m-85 -96.86 108.04 20.65 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.272 0.558 . . . . 0.0 109.584 176.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -106.53 146.23 32.62 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.267 -176.672 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.622 ' HA ' HD23 ' A' ' 49' ' ' LEU . 41.8 Cg_endo -66.08 127.57 17.9 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 122.958 2.438 . . . . 0.0 112.551 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.571 ' HB2' ' HD2' ' A' ' 50' ' ' TYR . . . -91.02 37.16 0.92 Allowed 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.052 -178.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 67.77 109.8 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.989 0.806 . . . . 0.0 110.52 -175.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.539 ' HG2' ' HG3' ' A' ' 47' ' ' GLN . 33.6 mt-10 -73.12 -31.62 64.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.914 -173.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.689 -0.672 . . . . 0.0 109.931 175.386 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.783 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 3' ' ' MET . . . 73.24 -35.94 0.34 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.574 0.75 . . . . 0.0 112.63 178.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.422 ' HB2' ' O ' ' A' ' 2' ' ' ALA . 87.9 mmm 74.82 -32.23 0.22 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 123.599 0.759 . . . . 0.0 112.211 177.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -85.11 -19.34 59.28 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.12 177.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.44 HG23 ' HB2' ' A' ' 8' ' ' ALA . 7.8 m -86.54 74.66 9.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.745 0.783 . . . . 0.0 110.641 -178.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -96.58 -38.02 10.13 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 114.977 -1.011 . . . . 0.0 108.474 172.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -131.36 105.88 7.91 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.806 174.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.44 ' HB2' HG23 ' A' ' 5' ' ' THR . . . -103.23 -176.87 3.21 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.948 179.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.426 HG12 ' HE1' ' A' ' 51' ' ' TRP . 22.7 m -51.47 123.8 23.23 Favored Pre-proline 0 C--N 1.325 -0.477 0 CA-C-O 121.621 0.724 . . . . 0.0 111.716 179.077 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -78.62 132.44 10.97 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.754 2.303 . . . . 0.0 112.664 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -98.05 127.98 44.31 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 173.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 29.4 p -79.48 -7.17 58.25 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 121.146 0.498 . . . . 0.0 111.075 -177.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.9 m -81.08 -23.7 38.29 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.656 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.9 p -87.84 10.74 17.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.976 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 16.3 m-30 -93.7 162.48 13.92 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.849 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -107.49 112.32 25.03 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.581 177.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 85.2 t80 -69.56 125.9 28.13 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.944 0.402 . . . . 0.0 110.629 -177.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -100.63 132.58 45.95 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.79 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -84.86 -33.41 22.85 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.637 -0.711 . . . . 0.0 112.585 -174.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.8 t -75.33 -28.79 59.77 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.261 0.553 . . . . 0.0 109.968 -174.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 66.3 m -107.0 -25.69 11.5 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.269 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.27 22.0 68.95 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.724 178.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 84.4 m-85 -117.05 154.53 30.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.824 0.345 . . . . 0.0 110.555 -178.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.801 ' HB2' ' HB3' ' A' ' 33' ' ' TYR . 73.3 m-85 -89.18 111.1 21.8 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.177 174.362 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.6 t80 -74.57 122.59 23.36 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.029 0.442 . . . . 0.0 111.004 -178.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.438 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 5.6 t70 -94.52 111.4 53.76 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.273 175.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 2.0 Cg_endo -84.33 -11.73 8.26 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.446 2.764 . . . . 0.0 111.799 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.83 -52.59 14.29 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.856 -178.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.9 m -104.95 -38.74 6.51 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.267 -179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 111.38 38.28 1.51 Allowed Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.792 -0.718 . . . . 0.0 111.423 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.1 mt -115.73 174.35 6.07 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.998 0.428 . . . . 0.0 110.425 -174.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 53.3 m-85 -123.13 125.83 45.88 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.819 174.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.801 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 81.3 t80 -90.41 127.16 36.12 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 120.908 0.385 . . . . 0.0 110.223 178.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.401 ' HA ' ' HD2' ' A' ' 35' ' ' PRO . 44.3 t0 -88.96 106.82 14.36 Favored Pre-proline 0 C--N 1.318 -0.761 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.464 178.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.575 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 24.9 Cg_endo -66.83 -21.34 50.93 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.655 2.237 . . . . 0.0 112.416 179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -89.04 -43.68 10.92 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.613 -174.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 6.1 m -92.65 -16.47 25.53 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.274 -178.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 63.18 36.44 12.02 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.712 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -131.64 169.64 15.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.465 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -97.6 149.84 21.8 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.893 0.377 . . . . 0.0 110.505 179.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -119.12 121.15 39.12 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.599 -178.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.531 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 46.7 t-20 -82.08 108.87 15.91 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.3 p -73.62 -12.78 60.86 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 120.903 0.382 . . . . 0.0 111.723 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.6 tp -90.63 -45.56 8.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.818 0.342 . . . . 0.0 111.121 -179.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 m -99.19 -12.96 19.96 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.147 0.498 . . . . 0.0 111.322 -175.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 63.48 63.58 0.87 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.786 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.531 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 4.5 pt20 -146.2 162.81 37.21 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.112 -176.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.711 ' HB2' ' HB3' ' A' ' 62' ' ' ALA . 6.9 m-85 -103.5 137.48 41.52 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.275 0.559 . . . . 0.0 110.812 178.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.637 HD23 ' HA ' ' A' ' 60' ' ' PRO . 16.5 mt -133.55 165.46 24.83 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.837 -171.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.619 ' HD1' ' HB2' ' A' ' 61' ' ' ALA . 37.1 p90 -143.4 150.33 38.94 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 173.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.426 ' HE1' HG12 ' A' ' 9' ' ' VAL . 56.8 t-105 -87.42 120.53 28.81 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 120.883 0.373 . . . . 0.0 110.534 -178.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.476 ' OD1' ' HG2' ' A' ' 55' ' ' LYS . 13.0 t70 -102.02 124.02 46.91 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -66.42 -18.77 68.0 Favored Glycine 0 CA--C 1.52 0.39 0 CA-C-N 115.905 -0.588 . . . . 0.0 114.111 -173.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -96.33 -41.49 8.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 117.316 0.558 . . . . 0.0 110.458 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.476 ' HG2' ' OD1' ' A' ' 52' ' ' ASP . 10.9 mmmm -73.7 -18.24 61.03 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.944 -177.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 57.25 38.03 28.52 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 115.014 -0.994 . . . . 0.0 111.373 175.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.441 HG23 HG13 ' A' ' 59' ' ' VAL . 13.0 t -158.7 163.23 37.02 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.861 -178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -87.59 108.84 19.25 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.441 HG13 HG23 ' A' ' 57' ' ' THR . 0.2 OUTLIER -101.79 142.63 24.97 Favored Pre-proline 0 C--N 1.314 -0.973 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.265 -175.836 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.637 ' HA ' HD23 ' A' ' 49' ' ' LEU . 22.0 Cg_exo -65.07 122.49 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.281 0 C-N-CA 122.863 2.376 . . . . 0.0 113.108 -174.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.619 ' HB2' ' HD1' ' A' ' 50' ' ' TYR . . . -97.68 -35.17 10.66 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.517 178.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.711 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . . . -125.23 100.22 6.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.472 -179.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -110.37 140.45 44.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.045 178.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.3 p . . . . . 0 C--O 1.246 0.919 0 CA-C-O 119.093 -0.479 . . . . 0.0 110.638 -179.496 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.542 0 N-CA-C 111.776 -0.53 . . . . 0.0 111.776 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -91.5 -38.2 12.67 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.848 0.356 . . . . 0.0 110.351 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 49.1 ttm -67.73 -38.55 83.71 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.301 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -103.09 -104.81 2.91 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.899 -0.667 . . . . 0.0 111.978 177.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 13.9 t -133.93 154.5 51.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.006 0.431 . . . . 0.0 110.917 -178.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.0 pttp -125.88 -159.75 0.93 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 175.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -56.05 115.25 2.32 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 171.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -127.98 178.89 5.88 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.722 -177.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.485 HG12 ' HE1' ' A' ' 51' ' ' TRP . 15.6 m -59.7 119.74 43.21 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.387 0.613 . . . . 0.0 111.357 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -85.0 139.37 7.25 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 123.152 2.568 . . . . 0.0 113.325 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -101.39 124.42 47.04 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 173.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.521 ' HA ' ' CD1' ' A' ' 15' ' ' TYR . 35.1 p -75.45 -12.02 60.16 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.567 -176.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.4 m -72.16 -23.72 61.33 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.759 179.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 17.7 p -96.57 18.13 14.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.887 0.375 . . . . 0.0 111.804 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.521 ' CD1' ' HA ' ' A' ' 12' ' ' THR . 16.3 m-30 -93.28 171.6 8.82 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.964 0.412 . . . . 0.0 110.706 176.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -109.68 103.91 12.83 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.237 179.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -67.64 123.64 21.03 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.916 0.389 . . . . 0.0 110.141 -179.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -104.54 137.5 42.31 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.287 179.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -83.64 -29.55 27.59 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.571 -174.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.9 m -84.99 -30.12 24.47 Favored 'General case' 0 N--CA 1.437 -1.123 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.071 -175.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.5 t -95.59 -24.92 16.37 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.07 178.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 74.53 8.49 80.87 Favored Glycine 0 C--N 1.333 0.4 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.992 178.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.468 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 58.5 m-85 -118.46 166.37 12.76 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.056 0.455 . . . . 0.0 110.558 -179.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.633 ' HE2' ' HB3' ' A' ' 35' ' ' PRO . 80.1 m-85 -89.53 113.12 24.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.472 172.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -74.28 129.78 38.46 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.026 0.441 . . . . 0.0 110.591 -177.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.411 ' HA ' ' HD2' ' A' ' 27' ' ' PRO . 6.3 t70 -100.84 99.7 10.97 Favored Pre-proline 0 C--N 1.322 -0.628 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.234 177.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' A' ' 26' ' ' ASP . 60.2 Cg_endo -74.19 -11.63 23.12 Favored 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 123.106 2.537 . . . . 0.0 112.54 174.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.19 -46.99 66.11 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.928 0.394 . . . . 0.0 110.81 -177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.5 m -116.16 -41.88 3.11 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.668 178.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 122.28 36.83 0.68 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.725 -0.75 . . . . 0.0 111.555 179.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 96.8 mt -117.83 178.08 4.54 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.882 0.372 . . . . 0.0 110.844 -175.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -122.73 125.49 45.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.04 175.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.55 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 82.3 t80 -92.97 121.33 34.2 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.951 -0.389 . . . . 0.0 109.951 176.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.468 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 22.9 t0 -85.55 114.16 55.0 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.307 -0.406 . . . . 0.0 109.987 176.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.633 ' HB3' ' HE2' ' A' ' 24' ' ' TYR . 19.1 Cg_endo -62.05 -21.59 72.68 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.618 2.212 . . . . 0.0 112.634 178.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -84.93 -53.29 5.41 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.84 -0.344 . . . . 0.0 110.928 -176.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.474 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 19.1 m -83.18 -19.46 36.51 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 66.25 29.58 9.55 Favored 'General case' 0 N--CA 1.467 0.38 0 O-C-N 123.598 0.561 . . . . 0.0 110.696 -176.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.474 ' HD1' ' HB3' ' A' ' 37' ' ' SER . 52.4 m-85 -120.95 163.83 17.65 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.721 179.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -98.15 141.5 31.0 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.238 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -115.57 116.18 27.71 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.83 -176.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 46' ' ' GLN . 44.4 t-20 -74.43 119.08 18.14 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.068 -0.716 . . . . 0.0 109.068 177.431 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.1 p -75.95 -16.73 59.96 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 63.7 tp -92.78 -57.71 2.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.982 0.42 . . . . 0.0 111.093 -179.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 m -87.17 -14.17 41.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.637 0.732 . . . . 0.0 110.885 -175.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.455 ' HA ' ' O ' ' A' ' 42' ' ' ASN . 77.1 mt-30 60.02 47.84 9.28 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 114.548 -1.205 . . . . 0.0 111.576 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -119.32 169.36 10.06 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.627 177.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -109.7 138.25 46.34 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.502 0.668 . . . . 0.0 111.351 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.605 HD23 ' HA ' ' A' ' 60' ' ' PRO . 18.2 mt -134.99 169.55 17.24 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.319 -173.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.466 ' HB3' ' HD2' ' A' ' 39' ' ' TYR . 34.2 p90 -150.06 149.92 31.0 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 173.206 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.485 ' HE1' HG12 ' A' ' 9' ' ' VAL . 64.0 t-105 -83.59 119.05 24.26 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.81 0.338 . . . . 0.0 110.347 178.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.412 ' OD1' ' HB3' ' A' ' 54' ' ' GLU . 32.5 t70 -104.23 133.91 48.35 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.949 174.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.79 -11.61 85.26 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.967 -0.635 . . . . 0.0 113.341 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.412 ' HB3' ' OD1' ' A' ' 52' ' ' ASP . 11.2 tp10 -90.12 -49.42 6.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.168 0.508 . . . . 0.0 110.043 179.703 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 11.4 mmmm -80.77 -18.09 48.78 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.568 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 46.38 61.99 2.5 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.438 0.637 . . . . 0.0 111.448 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.485 HG23 HG13 ' A' ' 59' ' ' VAL . 14.7 t -169.95 170.19 7.78 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.149 -0.932 . . . . 0.0 108.713 177.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -89.56 99.74 12.68 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 177.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.485 HG13 HG23 ' A' ' 57' ' ' THR . 3.3 m -95.7 145.55 29.75 Favored Pre-proline 0 C--N 1.313 -0.985 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.458 -176.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.605 ' HA ' HD23 ' A' ' 49' ' ' LEU . 27.6 Cg_endo -62.27 122.93 11.57 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.659 2.239 . . . . 0.0 112.321 -177.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -66.18 -26.61 67.49 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.135 179.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -109.84 129.89 55.59 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.697 173.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -89.48 22.26 3.04 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.11 0.481 . . . . 0.0 110.968 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 m . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.546 -0.74 . . . . 0.0 110.146 177.89 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 111.861 -0.496 . . . . 0.0 111.861 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.65 50.2 2.24 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.077 0.465 . . . . 0.0 111.047 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.4 mmt -134.45 -65.93 0.62 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.15 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -169.36 85.79 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.093 -0.803 . . . . 0.0 111.093 179.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.2 p -66.19 109.52 2.66 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.26 0.552 . . . . 0.0 111.523 -178.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -77.46 -46.65 21.89 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 176.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -136.35 110.49 8.34 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.026 -0.988 . . . . 0.0 109.192 176.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -100.88 178.33 4.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.062 -178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 10' ' ' PRO . 29.9 m -63.62 137.62 97.14 Favored Pre-proline 0 C--O 1.236 0.368 0 CA-C-O 121.154 0.502 . . . . 0.0 110.844 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 76.1 Cg_endo -88.58 132.81 2.57 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.905 2.403 . . . . 0.0 113.125 -177.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -96.1 135.27 38.12 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.267 173.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.46 HG22 ' CE2' ' A' ' 15' ' ' TYR . 25.7 p -87.82 -6.57 58.06 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.157 0.503 . . . . 0.0 110.92 -177.284 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.8 m -81.76 -8.7 59.72 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.357 178.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 21.6 p -105.0 18.29 22.63 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.786 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.46 ' CE2' HG22 ' A' ' 12' ' ' THR . 21.9 m-30 -100.93 171.22 7.78 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.569 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 66.3 mt-30 -117.55 104.93 11.54 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 177.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -66.11 117.13 8.0 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 120.745 -0.382 . . . . 0.0 110.312 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -97.14 130.56 44.38 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.153 176.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -84.21 -23.62 30.43 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.873 -177.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 45.0 t -73.33 -30.18 63.18 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.208 -178.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 13.9 m -107.57 -30.25 8.72 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.065 -179.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 89.91 8.15 67.51 Favored Glycine 0 C--N 1.332 0.34 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.475 177.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 -119.86 165.13 15.0 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.85 0.357 . . . . 0.0 110.725 -176.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -88.27 111.6 21.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.711 175.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -74.69 128.96 36.82 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.922 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -98.67 101.02 10.65 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.979 174.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -67.14 -17.23 50.42 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.917 2.411 . . . . 0.0 112.341 176.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.6 m -65.9 -58.99 4.31 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.855 -178.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.65 -34.6 9.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.046 -177.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 109.32 37.61 1.92 Allowed Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.458 -179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 83.2 mt -119.12 178.84 4.36 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 120.872 0.368 . . . . 0.0 110.588 -174.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -127.11 125.08 40.63 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.012 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -91.17 123.41 34.6 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.573 -0.529 . . . . 0.0 109.573 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -89.96 114.97 62.77 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.141 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 21.0 Cg_endo -66.82 -12.67 36.93 Favored 'Trans proline' 0 C--O 1.233 0.236 0 C-N-CA 122.584 2.189 . . . . 0.0 112.209 176.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -87.02 -53.09 5.07 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.811 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.492 ' HB2' ' HD2' ' A' ' 39' ' ' TYR . 37.1 p -89.6 -20.03 24.23 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.241 0.46 . . . . 0.0 112.241 -178.094 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 68.9 26.53 5.82 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.291 0.636 . . . . 0.0 110.78 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . 0.504 ' HD1' ' HB3' ' A' ' 50' ' ' TYR . 63.2 m-85 -115.29 166.14 12.18 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.415 176.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -98.69 142.27 30.46 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.356 177.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 70.3 t80 -116.73 118.75 33.41 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.72 -176.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 41.4 t-20 -79.39 114.13 18.08 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 176.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 t -74.49 -13.31 60.67 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 120.941 -0.303 . . . . 0.0 111.065 -174.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 57.7 tp -87.46 -50.97 6.19 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.774 0.321 . . . . 0.0 110.947 179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 31.0 p -96.27 -13.03 23.69 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.634 -175.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 65.34 35.42 7.56 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.25 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -107.89 174.57 5.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.01 178.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 30.9 m-85 -116.23 145.61 42.99 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.939 178.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.796 HD23 ' HA ' ' A' ' 60' ' ' PRO . 13.9 mt -138.54 170.19 16.44 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.322 -177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.504 ' HB3' ' HD1' ' A' ' 39' ' ' TYR . 37.6 p90 -148.3 146.38 28.55 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 172.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 70.7 t-105 -82.51 114.47 20.95 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.697 -179.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -98.34 121.17 39.94 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 174.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -76.43 -18.08 79.44 Favored Glycine 0 N--CA 1.452 -0.276 0 CA-C-N 115.934 -0.575 . . . . 0.0 113.303 -172.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -86.83 -40.4 14.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.151 0.5 . . . . 0.0 109.918 -178.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -89.17 -11.09 44.79 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.581 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 60.82 41.02 15.18 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.805 173.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.631 HG23 HG13 ' A' ' 59' ' ' VAL . 8.8 t -155.58 152.62 29.0 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.757 0.313 . . . . 0.0 111.058 -176.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 52.2 m-85 -83.15 106.22 14.77 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 173.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.631 HG13 HG23 ' A' ' 57' ' ' THR . 0.1 OUTLIER -101.46 138.04 19.79 Favored Pre-proline 0 C--N 1.315 -0.912 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.53 -172.855 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.796 ' HA ' HD23 ' A' ' 49' ' ' LEU . 33.1 Cg_exo -57.83 122.72 12.23 Favored 'Trans proline' 0 CA--C 1.515 -0.448 0 C-N-CA 123.175 2.583 . . . . 0.0 112.9 -175.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -83.13 66.87 8.92 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.166 -0.925 . . . . 0.0 109.908 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -133.54 -67.24 0.61 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.634 -0.712 . . . . 0.0 109.953 179.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -90.32 52.54 2.26 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.411 0.624 . . . . 0.0 109.873 177.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 C--O 1.247 0.958 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.54 -177.615 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.801 0 N-CA-C 111.966 -0.453 . . . . 0.0 111.966 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.33 -78.82 0.14 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.828 0.347 . . . . 0.0 110.757 179.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.4 ptp -128.69 -6.21 5.15 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.958 179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 160.45 55.99 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.764 -0.732 . . . . 0.0 111.951 -178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 5.1 m -119.0 119.62 34.83 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 120.967 0.413 . . . . 0.0 110.295 -179.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -117.78 -63.19 1.46 Allowed 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.014 -0.539 . . . . 0.0 109.843 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -113.28 133.12 55.27 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.427 177.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -112.33 176.9 4.83 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.572 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.418 HG12 ' HE1' ' A' ' 51' ' ' TRP . 20.6 m -54.38 128.67 59.93 Favored Pre-proline 0 C--N 1.327 -0.397 0 CA-C-O 120.982 0.42 . . . . 0.0 111.139 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 9' ' ' VAL . 62.9 Cg_endo -86.42 132.09 3.61 Favored 'Trans proline' 0 N--CA 1.452 -0.913 0 C-N-CA 122.566 2.178 . . . . 0.0 112.622 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -94.91 128.85 41.99 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.286 -0.87 . . . . 0.0 109.257 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.603 HG22 ' CE2' ' A' ' 15' ' ' TYR . 42.4 p -81.21 -4.77 56.51 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.428 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.6 m -70.56 -26.19 63.43 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.095 178.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.2 t -94.42 12.12 28.27 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.844 0.354 . . . . 0.0 111.416 -176.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.603 ' CE2' HG22 ' A' ' 12' ' ' THR . 18.2 m-30 -86.4 167.11 15.02 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.939 0.399 . . . . 0.0 110.668 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -114.71 111.5 21.38 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.687 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -68.31 120.27 14.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.99 0.424 . . . . 0.0 110.508 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -98.42 121.61 40.57 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 176.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -84.13 -18.37 37.01 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.152 0.501 . . . . 0.0 111.387 -175.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.5 t -86.72 -24.45 25.17 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 -179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.3 t -101.64 -30.81 11.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.285 178.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 87.29 8.09 75.38 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 121.125 -0.559 . . . . 0.0 112.668 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.551 ' HD1' ' HA ' ' A' ' 34' ' ' ASP . 68.2 m-85 -123.76 160.76 26.61 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.043 0.449 . . . . 0.0 111.048 -175.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.446 ' HE1' ' HB3' ' A' ' 35' ' ' PRO . 72.4 m-85 -86.86 111.33 20.67 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.082 174.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -74.51 124.13 26.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 120.987 0.422 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.484 ' HA ' ' HD3' ' A' ' 27' ' ' PRO . 13.5 t70 -94.84 116.51 66.44 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.073 174.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 26' ' ' ASP . 3.0 Cg_endo -84.65 -13.72 6.9 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 123.042 2.495 . . . . 0.0 111.9 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 m -68.66 -53.78 20.34 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.554 -179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.75 -36.75 8.17 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.642 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 105.22 40.0 2.17 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.661 -0.78 . . . . 0.0 111.243 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 84.7 mt -121.11 173.3 7.37 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.863 0.363 . . . . 0.0 110.646 -173.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.485 ' HB2' ' HB3' ' A' ' 41' ' ' TYR . 44.5 m-85 -115.07 125.38 53.46 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.405 175.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.433 ' HB3' ' HB2' ' A' ' 24' ' ' TYR . 59.6 t80 -92.44 117.01 29.49 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.027 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.551 ' HA ' ' HD1' ' A' ' 23' ' ' TYR . 10.3 t70 -77.13 111.85 19.34 Favored Pre-proline 0 C--N 1.327 -0.411 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 176.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.446 ' HB3' ' HE1' ' A' ' 24' ' ' TYR . 27.4 Cg_endo -67.03 -19.44 51.65 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.302 2.001 . . . . 0.0 113.38 -177.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -89.83 -49.1 6.82 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.686 0.279 . . . . 0.0 111.104 -175.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 67.1 m -93.76 -17.05 23.56 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.157 0.503 . . . . 0.0 111.373 -178.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 63.46 37.38 10.66 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.942 178.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -114.56 161.22 18.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.399 173.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -97.33 137.75 35.85 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.332 178.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.485 ' HB3' ' HB2' ' A' ' 32' ' ' TYR . 45.8 t80 -111.36 117.79 34.07 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.917 -179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.465 ' HB3' ' HG2' ' A' ' 47' ' ' GLN . 47.1 t-20 -79.12 113.1 16.98 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.3 t -77.08 -15.06 59.71 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.752 -0.203 . . . . 0.0 111.511 -174.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 60.3 tp -91.53 -43.2 9.81 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.973 0.415 . . . . 0.0 110.7 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.7 m -97.61 -13.46 21.56 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.3 0.572 . . . . 0.0 111.133 -176.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 62.88 43.58 6.8 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.194 -0.912 . . . . 0.0 111.041 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.465 ' HG2' ' HB3' ' A' ' 42' ' ' ASN . 15.3 pt20 -122.5 166.59 14.55 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.014 -178.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.427 ' HB2' ' HB2' ' A' ' 64' ' ' SER . 15.3 m-85 -108.94 141.47 40.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.242 0.544 . . . . 0.0 110.865 178.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.598 HD23 ' HA ' ' A' ' 60' ' ' PRO . 14.1 mt -135.2 164.98 26.46 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.412 -172.565 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 42.3 p90 -140.01 145.69 38.1 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 175.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TRP . . . . . 0.418 ' HE1' HG12 ' A' ' 9' ' ' VAL . 70.0 t-105 -76.98 123.3 26.13 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.468 -0.493 . . . . 0.0 110.161 176.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -105.98 120.38 41.62 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 175.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -78.73 -10.2 86.4 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.294 -174.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 25.2 tp10 -97.09 -43.43 7.41 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.058 0.456 . . . . 0.0 109.922 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.407 ' HD2' HG21 ' A' ' 59' ' ' VAL . 80.5 mttt -80.2 -18.27 50.06 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.36 179.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 58.68 48.54 11.47 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 114.999 -1.0 . . . . 0.0 110.651 -179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . 0.649 HG23 HG22 ' A' ' 59' ' ' VAL . 9.9 t -159.05 156.64 29.61 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.451 -175.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -85.07 108.32 17.59 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 171.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.649 HG22 HG23 ' A' ' 57' ' ' THR . 0.2 OUTLIER -102.1 143.44 26.61 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.535 -173.702 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.633 ' HD2' HG12 ' A' ' 59' ' ' VAL . 45.7 Cg_exo -56.06 130.22 39.09 Favored 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.684 2.256 . . . . 0.0 111.955 177.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.92 0.62 20.32 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.751 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 73.37 -36.17 0.34 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.666 0.786 . . . . 0.0 112.699 175.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -66.74 -24.71 66.26 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.81 0.338 . . . . 0.0 111.536 -179.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.427 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 49.5 m . . . . . 0 C--O 1.246 0.902 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.377 176.389 . . . . . . . . 1 1 . 1 stop_ save_